USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 805 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 190 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 188 THR OG1 : rot 92:sc= 0.0533 USER MOD Set 2.2: A 206 MET CE :methyl -109:sc= -0.492 (180deg=-1.33) USER MOD Set 3.1: A 177 HIS : no HE2:sc= -0.556 K(o=-0.66,f=-1.2) USER MOD Set 3.2: A 181 ASN : amide:sc= -0.099 K(o=-0.66,f=-1.2) USER MOD Single : A 128 TYR OH : rot 165:sc= 1.29 USER MOD Single : A 129 MET CE :methyl 156:sc= -1.27 (180deg=-3.26!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -143:sc=-0.00519 (180deg=-0.299) USER MOD Single : A 135 SER OG : rot 180:sc= 0.124 USER MOD Single : A 138 MET CE :methyl -133:sc= -0.112 (180deg=-0.664) USER MOD Single : A 140 HIS : no HD1:sc= -0.392 X(o=-0.39,f=0.0069) USER MOD Single : A 143 ASN : amide:sc= 0.118 X(o=0.12,f=-0.12) USER MOD Single : A 149 TYR OH : rot 180:sc= -0.0909 USER MOD Single : A 150 TYR OH : rot 146:sc= 1.24 USER MOD Single : A 153 ASN :FLIP amide:sc= 0.645 F(o=-0.81,f=0.64) USER MOD Single : A 154 MET CE :methyl -174:sc= -0.323 (180deg=-0.367) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot -42:sc= 0.756 USER MOD Single : A 159 ASN : amide:sc= 0.101 K(o=0.1,f=-2.7!) USER MOD Single : A 160 GLN : amide:sc= -0.697 X(o=-0.7,f=-0.43) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.042) USER MOD Single : A 170 SER OG : rot 180:sc= 0.14 USER MOD Single : A 171 ASN : amide:sc= -0.0294 K(o=-0.029,f=-2.7!) USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= -1.63 K(o=-1.6,f=-5.4!) USER MOD Single : A 183 THR OG1 : rot 88:sc= 1.33 USER MOD Single : A 185 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00573) USER MOD Single : A 186 GLN : amide:sc= -0.307 X(o=-0.31,f=-0.42) USER MOD Single : A 187 HIS : no HE2:sc= -1.71 X(o=-1.7,f=-1.6) USER MOD Single : A 191 THR OG1 : rot -160:sc= -0.233 USER MOD Single : A 192 THR OG1 : rot -54:sc= -0.569 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 197 ASN :FLIP amide:sc= -0.0174 F(o=-0.54,f=-0.017) USER MOD Single : A 199 THR OG1 : rot 76:sc= 1.2 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -162:sc= -0.218 (180deg=-1.06) USER MOD Single : A 212 GLN : amide:sc=-0.00661 X(o=-0.0066,f=-0.18) USER MOD Single : A 213 MET CE :methyl 176:sc= -0.457 (180deg=-0.544) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.329 K(o=-0.33,f=-2) USER MOD Single : A 218 TYR OH : rot 180:sc= -0.026 USER MOD Single : A 219 GLN :FLIP amide:sc= -0.0184 F(o=-1.1,f=-0.018) USER MOD Single : A 220 LYS NZ :NH3+ -162:sc= -0.208 (180deg=-0.77) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.092 F(o=-1.8,f=-0.092) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 8.987 -13.763 -0.969 1.00 0.00 N ATOM 66 CA LEU A 125 9.241 -12.733 -1.976 1.00 0.00 C ATOM 67 C LEU A 125 10.750 -12.654 -2.222 1.00 0.00 C ATOM 68 O LEU A 125 11.529 -13.111 -1.385 1.00 0.00 O ATOM 69 CB LEU A 125 8.721 -11.355 -1.536 1.00 0.00 C ATOM 70 CG LEU A 125 7.198 -11.170 -1.518 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.842 -9.717 -1.198 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.500 -11.481 -2.847 1.00 0.00 C ATOM 0 HA LEU A 125 8.710 -13.006 -2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.101 -11.151 -0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.148 -10.602 -2.199 1.00 0.00 H new ATOM 0 HG LEU A 125 6.854 -11.877 -0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.758 -9.601 -1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.244 -9.451 -0.220 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.270 -9.062 -1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.427 -11.323 -2.740 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.888 -10.823 -3.625 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.688 -12.519 -3.123 1.00 0.00 H new ATOM 84 N GLY A 126 11.159 -11.997 -3.311 1.00 0.00 N ATOM 85 CA GLY A 126 12.516 -11.812 -3.817 1.00 0.00 C ATOM 86 C GLY A 126 13.306 -10.830 -2.963 1.00 0.00 C ATOM 87 O GLY A 126 13.713 -9.761 -3.420 1.00 0.00 O ATOM 0 H GLY A 126 10.479 -11.538 -3.917 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.031 -12.773 -3.838 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.475 -11.450 -4.844 1.00 0.00 H new ATOM 91 N GLY A 127 13.459 -11.183 -1.693 1.00 0.00 N ATOM 92 CA GLY A 127 14.106 -10.389 -0.665 1.00 0.00 C ATOM 93 C GLY A 127 13.434 -9.030 -0.533 1.00 0.00 C ATOM 94 O GLY A 127 14.135 -8.028 -0.383 1.00 0.00 O ATOM 0 H GLY A 127 13.117 -12.076 -1.338 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.064 -10.915 0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 127 15.160 -10.257 -0.910 1.00 0.00 H new ATOM 98 N TYR A 128 12.102 -8.972 -0.628 1.00 0.00 N ATOM 99 CA TYR A 128 11.387 -7.726 -0.452 1.00 0.00 C ATOM 100 C TYR A 128 11.594 -7.298 0.995 1.00 0.00 C ATOM 101 O TYR A 128 11.710 -8.129 1.900 1.00 0.00 O ATOM 102 CB TYR A 128 9.902 -7.904 -0.788 1.00 0.00 C ATOM 103 CG TYR A 128 9.571 -7.763 -2.264 1.00 0.00 C ATOM 104 CD1 TYR A 128 10.199 -8.598 -3.197 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.594 -6.853 -2.709 1.00 0.00 C ATOM 106 CE1 TYR A 128 9.823 -8.583 -4.542 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.200 -6.834 -4.065 1.00 0.00 C ATOM 108 CZ TYR A 128 8.798 -7.727 -4.987 1.00 0.00 C ATOM 109 OH TYR A 128 8.405 -7.813 -6.287 1.00 0.00 O ATOM 0 H TYR A 128 11.508 -9.777 -0.826 1.00 0.00 H new ATOM 0 HA TYR A 128 11.762 -6.956 -1.126 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.581 -8.889 -0.449 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.324 -7.169 -0.227 1.00 0.00 H new ATOM 0 HD1 TYR A 128 10.985 -9.263 -2.872 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.143 -6.165 -2.009 1.00 0.00 H new ATOM 0 HE1 TYR A 128 10.322 -9.233 -5.246 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.443 -6.139 -4.398 1.00 0.00 H new ATOM 0 HH TYR A 128 7.548 -7.352 -6.401 1.00 0.00 H new ATOM 119 N MET A 129 11.648 -5.993 1.174 1.00 0.00 N ATOM 120 CA MET A 129 11.638 -5.346 2.468 1.00 0.00 C ATOM 121 C MET A 129 10.185 -5.155 2.857 1.00 0.00 C ATOM 122 O MET A 129 9.297 -5.305 2.020 1.00 0.00 O ATOM 123 CB MET A 129 12.313 -3.971 2.373 1.00 0.00 C ATOM 124 CG MET A 129 13.723 -3.915 1.771 1.00 0.00 C ATOM 125 SD MET A 129 15.084 -4.112 2.944 1.00 0.00 S ATOM 126 CE MET A 129 14.689 -5.780 3.498 1.00 0.00 C ATOM 0 H MET A 129 11.702 -5.334 0.397 1.00 0.00 H new ATOM 0 HA MET A 129 12.174 -5.948 3.201 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.669 -3.320 1.782 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.359 -3.548 3.377 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.806 -4.694 1.013 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.843 -2.959 1.261 1.00 0.00 H new ATOM 0 HE1 MET A 129 15.590 -6.259 3.881 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.939 -5.733 4.288 1.00 0.00 H new ATOM 0 HE3 MET A 129 14.298 -6.359 2.661 1.00 0.00 H new ATOM 136 N LEU A 130 9.932 -4.772 4.101 1.00 0.00 N ATOM 137 CA LEU A 130 8.651 -4.318 4.578 1.00 0.00 C ATOM 138 C LEU A 130 8.896 -3.076 5.424 1.00 0.00 C ATOM 139 O LEU A 130 9.850 -3.042 6.203 1.00 0.00 O ATOM 140 CB LEU A 130 8.036 -5.492 5.339 1.00 0.00 C ATOM 141 CG LEU A 130 6.667 -5.207 5.947 1.00 0.00 C ATOM 142 CD1 LEU A 130 6.703 -4.344 7.205 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.649 -4.725 4.926 1.00 0.00 C ATOM 0 H LEU A 130 10.648 -4.772 4.827 1.00 0.00 H new ATOM 0 HA LEU A 130 7.949 -4.028 3.796 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.948 -6.341 4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.718 -5.789 6.136 1.00 0.00 H new ATOM 0 HG LEU A 130 6.315 -6.180 6.291 1.00 0.00 H new ATOM 0 HD11 LEU A 130 5.688 -4.191 7.570 1.00 0.00 H new ATOM 0 HD12 LEU A 130 7.293 -4.844 7.973 1.00 0.00 H new ATOM 0 HD13 LEU A 130 7.154 -3.379 6.972 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.696 -4.540 5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 130 6.004 -3.803 4.466 1.00 0.00 H new ATOM 0 HD23 LEU A 130 5.516 -5.486 4.157 1.00 0.00 H new ATOM 155 N GLY A 131 8.056 -2.054 5.251 1.00 0.00 N ATOM 156 CA GLY A 131 8.103 -0.798 5.998 1.00 0.00 C ATOM 157 C GLY A 131 7.690 -0.967 7.452 1.00 0.00 C ATOM 158 O GLY A 131 8.273 -1.721 8.229 1.00 0.00 O ATOM 0 H GLY A 131 7.301 -2.079 4.566 1.00 0.00 H new ATOM 0 HA2 GLY A 131 9.114 -0.392 5.956 1.00 0.00 H new ATOM 0 HA3 GLY A 131 7.447 -0.070 5.520 1.00 0.00 H new ATOM 162 N SER A 132 6.661 -0.228 7.812 1.00 0.00 N ATOM 163 CA SER A 132 6.060 -0.174 9.132 1.00 0.00 C ATOM 164 C SER A 132 4.541 -0.272 9.010 1.00 0.00 C ATOM 165 O SER A 132 3.985 -0.142 7.920 1.00 0.00 O ATOM 166 CB SER A 132 6.486 1.132 9.826 1.00 0.00 C ATOM 167 OG SER A 132 6.910 2.144 8.915 1.00 0.00 O ATOM 0 H SER A 132 6.192 0.390 7.150 1.00 0.00 H new ATOM 0 HA SER A 132 6.402 -1.014 9.737 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.651 1.511 10.416 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.297 0.917 10.522 1.00 0.00 H new ATOM 0 HG SER A 132 7.166 2.948 9.414 1.00 0.00 H new ATOM 173 N ALA A 133 3.863 -0.525 10.127 1.00 0.00 N ATOM 174 CA ALA A 133 2.429 -0.357 10.255 1.00 0.00 C ATOM 175 C ALA A 133 2.106 1.131 10.189 1.00 0.00 C ATOM 176 O ALA A 133 2.375 1.868 11.140 1.00 0.00 O ATOM 177 CB ALA A 133 1.961 -0.964 11.577 1.00 0.00 C ATOM 0 H ALA A 133 4.309 -0.859 10.981 1.00 0.00 H new ATOM 0 HA ALA A 133 1.909 -0.868 9.445 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.883 -0.838 11.674 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.205 -2.026 11.596 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.461 -0.462 12.405 1.00 0.00 H new ATOM 183 N MET A 134 1.539 1.562 9.069 1.00 0.00 N ATOM 184 CA MET A 134 1.065 2.931 8.889 1.00 0.00 C ATOM 185 C MET A 134 -0.355 3.064 9.435 1.00 0.00 C ATOM 186 O MET A 134 -0.833 2.179 10.151 1.00 0.00 O ATOM 187 CB MET A 134 1.174 3.372 7.421 1.00 0.00 C ATOM 188 CG MET A 134 2.599 3.263 6.886 1.00 0.00 C ATOM 189 SD MET A 134 2.961 4.497 5.612 1.00 0.00 S ATOM 190 CE MET A 134 4.498 3.784 5.027 1.00 0.00 C ATOM 0 H MET A 134 1.393 0.968 8.253 1.00 0.00 H new ATOM 0 HA MET A 134 1.705 3.606 9.457 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.511 2.759 6.810 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.831 4.402 7.327 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.302 3.380 7.710 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.753 2.265 6.475 1.00 0.00 H new ATOM 0 HE1 MET A 134 5.197 4.582 4.775 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.929 3.157 5.808 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.304 3.178 4.142 1.00 0.00 H new ATOM 200 N SER A 135 -1.008 4.181 9.135 1.00 0.00 N ATOM 201 CA SER A 135 -2.396 4.450 9.438 1.00 0.00 C ATOM 202 C SER A 135 -3.142 4.696 8.131 1.00 0.00 C ATOM 203 O SER A 135 -2.707 4.279 7.053 1.00 0.00 O ATOM 204 CB SER A 135 -2.462 5.610 10.433 1.00 0.00 C ATOM 205 OG SER A 135 -3.713 5.684 11.083 1.00 0.00 O ATOM 0 H SER A 135 -0.556 4.957 8.651 1.00 0.00 H new ATOM 0 HA SER A 135 -2.889 3.604 9.918 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.674 5.494 11.177 1.00 0.00 H new ATOM 0 HB3 SER A 135 -2.270 6.547 9.910 1.00 0.00 H new ATOM 0 HG SER A 135 -3.712 6.437 11.710 1.00 0.00 H new ATOM 211 N ARG A 136 -4.323 5.300 8.232 1.00 0.00 N ATOM 212 CA ARG A 136 -5.215 5.500 7.106 1.00 0.00 C ATOM 213 C ARG A 136 -4.982 6.890 6.521 1.00 0.00 C ATOM 214 O ARG A 136 -5.255 7.873 7.224 1.00 0.00 O ATOM 215 CB ARG A 136 -6.660 5.279 7.563 1.00 0.00 C ATOM 216 CG ARG A 136 -6.881 3.826 8.007 1.00 0.00 C ATOM 217 CD ARG A 136 -6.734 2.825 6.858 1.00 0.00 C ATOM 218 NE ARG A 136 -5.558 1.946 6.975 1.00 0.00 N ATOM 219 CZ ARG A 136 -5.507 0.797 7.666 1.00 0.00 C ATOM 220 NH1 ARG A 136 -6.423 0.475 8.574 1.00 0.00 N ATOM 221 NH2 ARG A 136 -4.527 -0.058 7.429 1.00 0.00 N ATOM 0 H ARG A 136 -4.687 5.667 9.111 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.014 4.779 6.313 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.892 5.954 8.387 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.344 5.522 6.750 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.167 3.578 8.792 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.877 3.731 8.440 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.632 2.209 6.810 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.673 3.373 5.918 1.00 0.00 H new ATOM 0 HE ARG A 136 -4.709 2.236 6.489 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -7.198 1.111 8.765 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.351 -0.408 9.080 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -3.820 0.159 6.727 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -4.478 -0.935 7.948 1.00 0.00 H new ATOM 235 N PRO A 137 -4.494 7.010 5.273 1.00 0.00 N ATOM 236 CA PRO A 137 -4.444 8.293 4.577 1.00 0.00 C ATOM 237 C PRO A 137 -5.859 8.822 4.330 1.00 0.00 C ATOM 238 O PRO A 137 -6.832 8.076 4.461 1.00 0.00 O ATOM 239 CB PRO A 137 -3.697 8.000 3.266 1.00 0.00 C ATOM 240 CG PRO A 137 -4.026 6.539 2.985 1.00 0.00 C ATOM 241 CD PRO A 137 -4.128 5.917 4.374 1.00 0.00 C ATOM 0 HA PRO A 137 -3.938 9.068 5.153 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.035 8.649 2.458 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.623 8.156 3.373 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.960 6.438 2.432 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -3.249 6.061 2.388 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.878 5.126 4.394 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -3.181 5.466 4.671 1.00 0.00 H new ATOM 249 N MET A 138 -5.979 10.088 3.933 1.00 0.00 N ATOM 250 CA MET A 138 -7.214 10.629 3.373 1.00 0.00 C ATOM 251 C MET A 138 -7.042 10.707 1.865 1.00 0.00 C ATOM 252 O MET A 138 -5.955 11.059 1.395 1.00 0.00 O ATOM 253 CB MET A 138 -7.541 12.017 3.944 1.00 0.00 C ATOM 254 CG MET A 138 -7.845 12.071 5.449 1.00 0.00 C ATOM 255 SD MET A 138 -8.335 10.540 6.296 1.00 0.00 S ATOM 256 CE MET A 138 -9.980 10.262 5.595 1.00 0.00 C ATOM 0 H MET A 138 -5.221 10.768 3.991 1.00 0.00 H new ATOM 0 HA MET A 138 -8.047 9.977 3.637 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.700 12.680 3.739 1.00 0.00 H new ATOM 0 HB3 MET A 138 -8.400 12.417 3.405 1.00 0.00 H new ATOM 0 HG2 MET A 138 -6.958 12.457 5.952 1.00 0.00 H new ATOM 0 HG3 MET A 138 -8.640 12.801 5.600 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.682 10.030 6.396 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.309 11.160 5.072 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.941 9.428 4.894 1.00 0.00 H new ATOM 266 N ILE A 139 -8.095 10.342 1.129 1.00 0.00 N ATOM 267 CA ILE A 139 -8.089 10.185 -0.325 1.00 0.00 C ATOM 268 C ILE A 139 -9.397 10.797 -0.830 1.00 0.00 C ATOM 269 O ILE A 139 -10.476 10.387 -0.399 1.00 0.00 O ATOM 270 CB ILE A 139 -7.930 8.695 -0.728 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.843 7.985 0.121 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.656 8.611 -2.243 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.232 6.720 -0.479 1.00 0.00 C ATOM 0 H ILE A 139 -9.005 10.141 1.544 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.239 10.694 -0.779 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.856 8.160 -0.518 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -6.039 8.696 0.311 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.277 7.730 1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.543 7.567 -2.535 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.490 9.052 -2.789 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.741 9.155 -2.478 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.487 6.316 0.206 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -7.015 5.979 -0.641 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.758 6.961 -1.430 1.00 0.00 H new ATOM 285 N HIS A 140 -9.322 11.807 -1.692 1.00 0.00 N ATOM 286 CA HIS A 140 -10.394 12.776 -1.918 1.00 0.00 C ATOM 287 C HIS A 140 -10.992 12.636 -3.316 1.00 0.00 C ATOM 288 O HIS A 140 -11.332 13.645 -3.941 1.00 0.00 O ATOM 289 CB HIS A 140 -9.885 14.197 -1.629 1.00 0.00 C ATOM 290 CG HIS A 140 -8.729 14.646 -2.492 1.00 0.00 C ATOM 291 ND1 HIS A 140 -8.779 15.558 -3.525 1.00 0.00 N ATOM 292 CD2 HIS A 140 -7.429 14.239 -2.362 1.00 0.00 C ATOM 293 CE1 HIS A 140 -7.530 15.714 -3.996 1.00 0.00 C ATOM 294 NE2 HIS A 140 -6.670 14.950 -3.299 1.00 0.00 N ATOM 0 H HIS A 140 -8.497 11.980 -2.266 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.209 12.570 -1.224 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -10.710 14.897 -1.760 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -9.582 14.253 -0.583 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -7.057 13.504 -1.664 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -7.256 16.360 -4.817 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -5.660 14.899 -3.428 1.00 0.00 H new ATOM 302 N PHE A 141 -11.153 11.389 -3.767 1.00 0.00 N ATOM 303 CA PHE A 141 -11.580 10.924 -5.090 1.00 0.00 C ATOM 304 C PHE A 141 -12.428 11.934 -5.864 1.00 0.00 C ATOM 305 O PHE A 141 -12.065 12.349 -6.966 1.00 0.00 O ATOM 306 CB PHE A 141 -12.359 9.605 -4.950 1.00 0.00 C ATOM 307 CG PHE A 141 -11.630 8.484 -4.242 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.667 8.381 -2.838 1.00 0.00 C ATOM 309 CD2 PHE A 141 -10.937 7.524 -4.999 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.989 7.334 -2.193 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.254 6.482 -4.350 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.272 6.390 -2.947 1.00 0.00 C ATOM 0 H PHE A 141 -10.968 10.598 -3.150 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.667 10.781 -5.668 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.286 9.807 -4.413 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.637 9.261 -5.946 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -12.217 9.107 -2.257 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.930 7.587 -6.077 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.019 7.254 -1.116 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.713 5.749 -4.931 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.736 5.595 -2.450 1.00 0.00 H new ATOM 322 N GLY A 142 -13.553 12.352 -5.293 1.00 0.00 N ATOM 323 CA GLY A 142 -14.407 13.404 -5.818 1.00 0.00 C ATOM 324 C GLY A 142 -15.865 13.054 -5.586 1.00 0.00 C ATOM 325 O GLY A 142 -16.669 13.938 -5.289 1.00 0.00 O ATOM 0 H GLY A 142 -13.904 11.952 -4.423 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.170 14.351 -5.333 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.221 13.536 -6.884 1.00 0.00 H new ATOM 329 N ASN A 143 -16.218 11.766 -5.683 1.00 0.00 N ATOM 330 CA ASN A 143 -17.571 11.326 -5.414 1.00 0.00 C ATOM 331 C ASN A 143 -17.668 11.078 -3.918 1.00 0.00 C ATOM 332 O ASN A 143 -16.786 10.416 -3.359 1.00 0.00 O ATOM 333 CB ASN A 143 -17.900 10.028 -6.159 1.00 0.00 C ATOM 334 CG ASN A 143 -17.277 9.890 -7.541 1.00 0.00 C ATOM 335 OD1 ASN A 143 -17.767 10.420 -8.533 1.00 0.00 O ATOM 336 ND2 ASN A 143 -16.175 9.185 -7.673 1.00 0.00 N ATOM 0 H ASN A 143 -15.576 11.018 -5.947 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.276 12.086 -5.750 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.575 9.186 -5.547 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.983 9.951 -6.258 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.740 9.085 -8.590 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.755 8.738 -6.858 1.00 0.00 H new ATOM 343 N ASP A 144 -18.735 11.535 -3.271 1.00 0.00 N ATOM 344 CA ASP A 144 -18.889 11.312 -1.833 1.00 0.00 C ATOM 345 C ASP A 144 -19.255 9.872 -1.516 1.00 0.00 C ATOM 346 O ASP A 144 -19.030 9.440 -0.389 1.00 0.00 O ATOM 347 CB ASP A 144 -19.968 12.207 -1.232 1.00 0.00 C ATOM 348 CG ASP A 144 -19.497 13.622 -0.916 1.00 0.00 C ATOM 349 OD1 ASP A 144 -18.274 13.872 -0.796 1.00 0.00 O ATOM 350 OD2 ASP A 144 -20.361 14.481 -0.647 1.00 0.00 O ATOM 0 H ASP A 144 -19.496 12.054 -3.708 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.920 11.552 -1.396 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.808 12.261 -1.925 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.339 11.746 -0.317 1.00 0.00 H new ATOM 355 N TRP A 145 -19.799 9.119 -2.477 1.00 0.00 N ATOM 356 CA TRP A 145 -20.021 7.700 -2.251 1.00 0.00 C ATOM 357 C TRP A 145 -18.678 6.979 -2.145 1.00 0.00 C ATOM 358 O TRP A 145 -18.534 6.143 -1.262 1.00 0.00 O ATOM 359 CB TRP A 145 -20.955 7.100 -3.307 1.00 0.00 C ATOM 360 CG TRP A 145 -20.482 7.142 -4.726 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.786 8.106 -5.623 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.634 6.184 -5.434 1.00 0.00 C ATOM 363 NE1 TRP A 145 -20.184 7.816 -6.832 1.00 0.00 N ATOM 364 CE2 TRP A 145 -19.409 6.681 -6.752 1.00 0.00 C ATOM 365 CE3 TRP A 145 -19.007 4.963 -5.094 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.550 6.048 -7.658 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -18.226 4.269 -6.037 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.978 4.819 -7.307 1.00 0.00 C ATOM 0 H TRP A 145 -20.085 9.463 -3.394 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.538 7.562 -1.301 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -21.144 6.060 -3.042 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.911 7.622 -3.252 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -21.404 8.969 -5.425 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -20.299 8.373 -7.678 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -19.129 4.559 -4.100 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.332 6.501 -8.614 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -17.813 3.304 -5.782 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -17.348 4.295 -8.010 1.00 0.00 H new ATOM 379 N GLU A 146 -17.686 7.340 -2.969 1.00 0.00 N ATOM 380 CA GLU A 146 -16.329 6.812 -2.855 1.00 0.00 C ATOM 381 C GLU A 146 -15.688 7.255 -1.551 1.00 0.00 C ATOM 382 O GLU A 146 -15.039 6.451 -0.896 1.00 0.00 O ATOM 383 CB GLU A 146 -15.445 7.254 -4.032 1.00 0.00 C ATOM 384 CG GLU A 146 -15.894 6.566 -5.321 1.00 0.00 C ATOM 385 CD GLU A 146 -14.818 6.520 -6.398 1.00 0.00 C ATOM 386 OE1 GLU A 146 -14.239 7.584 -6.693 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.603 5.460 -7.033 1.00 0.00 O ATOM 0 H GLU A 146 -17.806 8.006 -3.732 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.408 5.725 -2.872 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.501 8.336 -4.151 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.403 7.009 -3.825 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.207 5.548 -5.089 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.767 7.086 -5.715 1.00 0.00 H new ATOM 394 N ASP A 147 -15.871 8.522 -1.175 1.00 0.00 N ATOM 395 CA ASP A 147 -15.349 9.064 0.078 1.00 0.00 C ATOM 396 C ASP A 147 -15.893 8.271 1.269 1.00 0.00 C ATOM 397 O ASP A 147 -15.146 7.624 1.998 1.00 0.00 O ATOM 398 CB ASP A 147 -15.695 10.562 0.208 1.00 0.00 C ATOM 399 CG ASP A 147 -14.598 11.386 0.890 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.660 10.819 1.468 1.00 0.00 O ATOM 401 OD2 ASP A 147 -14.662 12.636 0.760 1.00 0.00 O ATOM 0 H ASP A 147 -16.387 9.202 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 147 -14.263 8.969 0.072 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.881 10.971 -0.785 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.621 10.665 0.774 1.00 0.00 H new ATOM 406 N ARG A 148 -17.216 8.252 1.443 1.00 0.00 N ATOM 407 CA ARG A 148 -17.860 7.567 2.555 1.00 0.00 C ATOM 408 C ARG A 148 -17.559 6.081 2.506 1.00 0.00 C ATOM 409 O ARG A 148 -17.341 5.497 3.553 1.00 0.00 O ATOM 410 CB ARG A 148 -19.364 7.900 2.612 1.00 0.00 C ATOM 411 CG ARG A 148 -20.325 6.934 1.900 1.00 0.00 C ATOM 412 CD ARG A 148 -21.792 7.373 2.020 1.00 0.00 C ATOM 413 NE ARG A 148 -22.057 8.626 1.287 1.00 0.00 N ATOM 414 CZ ARG A 148 -22.694 8.778 0.120 1.00 0.00 C ATOM 415 NH1 ARG A 148 -23.250 7.749 -0.506 1.00 0.00 N ATOM 416 NH2 ARG A 148 -22.788 9.999 -0.388 1.00 0.00 N ATOM 0 H ARG A 148 -17.870 8.715 0.811 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.445 7.930 3.495 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.658 7.957 3.660 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.506 8.893 2.186 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -20.054 6.867 0.846 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -20.212 5.936 2.323 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -22.439 6.584 1.635 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -22.045 7.508 3.072 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.712 9.481 1.723 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.198 6.815 -0.099 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -23.730 7.891 -1.395 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -22.381 10.791 0.109 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -23.268 10.146 -1.276 1.00 0.00 H new ATOM 430 N TYR A 149 -17.531 5.462 1.325 1.00 0.00 N ATOM 431 CA TYR A 149 -17.123 4.069 1.173 1.00 0.00 C ATOM 432 C TYR A 149 -15.724 3.873 1.718 1.00 0.00 C ATOM 433 O TYR A 149 -15.543 2.999 2.557 1.00 0.00 O ATOM 434 CB TYR A 149 -17.199 3.635 -0.306 1.00 0.00 C ATOM 435 CG TYR A 149 -16.729 2.227 -0.607 1.00 0.00 C ATOM 436 CD1 TYR A 149 -15.373 1.980 -0.883 1.00 0.00 C ATOM 437 CD2 TYR A 149 -17.648 1.163 -0.639 1.00 0.00 C ATOM 438 CE1 TYR A 149 -14.937 0.681 -1.178 1.00 0.00 C ATOM 439 CE2 TYR A 149 -17.213 -0.150 -0.879 1.00 0.00 C ATOM 440 CZ TYR A 149 -15.850 -0.387 -1.159 1.00 0.00 C ATOM 441 OH TYR A 149 -15.402 -1.628 -1.455 1.00 0.00 O ATOM 0 H TYR A 149 -17.791 5.914 0.448 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.809 3.442 1.743 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.232 3.732 -0.640 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.605 4.330 -0.900 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -14.664 2.795 -0.868 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -18.698 1.358 -0.477 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -13.900 0.501 -1.420 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -17.914 -0.971 -0.850 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.144 -2.265 -1.401 1.00 0.00 H new ATOM 451 N TYR A 150 -14.754 4.670 1.284 1.00 0.00 N ATOM 452 CA TYR A 150 -13.396 4.566 1.773 1.00 0.00 C ATOM 453 C TYR A 150 -13.384 4.629 3.292 1.00 0.00 C ATOM 454 O TYR A 150 -12.821 3.743 3.938 1.00 0.00 O ATOM 455 CB TYR A 150 -12.537 5.668 1.145 1.00 0.00 C ATOM 456 CG TYR A 150 -11.162 5.737 1.754 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.275 4.672 1.531 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.804 6.806 2.601 1.00 0.00 C ATOM 459 CE1 TYR A 150 -9.037 4.648 2.188 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.535 6.820 3.200 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.666 5.717 3.034 1.00 0.00 C ATOM 462 OH TYR A 150 -7.490 5.669 3.712 1.00 0.00 O ATOM 0 H TYR A 150 -14.892 5.401 0.586 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.970 3.606 1.483 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.449 5.490 0.073 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -13.036 6.629 1.269 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.546 3.874 0.856 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.502 7.609 2.788 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.367 3.813 2.048 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.223 7.671 3.787 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.118 6.573 3.786 1.00 0.00 H new ATOM 472 N ARG A 151 -14.048 5.626 3.881 1.00 0.00 N ATOM 473 CA ARG A 151 -14.071 5.715 5.334 1.00 0.00 C ATOM 474 C ARG A 151 -14.785 4.513 5.955 1.00 0.00 C ATOM 475 O ARG A 151 -14.280 3.967 6.936 1.00 0.00 O ATOM 476 CB ARG A 151 -14.657 7.055 5.788 1.00 0.00 C ATOM 477 CG ARG A 151 -13.666 8.220 5.587 1.00 0.00 C ATOM 478 CD ARG A 151 -13.914 8.998 4.298 1.00 0.00 C ATOM 479 NE ARG A 151 -13.349 10.350 4.352 1.00 0.00 N ATOM 480 CZ ARG A 151 -13.994 11.443 4.773 1.00 0.00 C ATOM 481 NH1 ARG A 151 -15.166 11.355 5.393 1.00 0.00 N ATOM 482 NH2 ARG A 151 -13.458 12.635 4.566 1.00 0.00 N ATOM 0 H ARG A 151 -14.560 6.359 3.390 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.044 5.680 5.698 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.572 7.258 5.231 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.933 6.992 6.841 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.737 8.901 6.435 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -12.649 7.827 5.578 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.478 8.457 3.459 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.986 9.061 4.114 1.00 0.00 H new ATOM 0 HE ARG A 151 -12.384 10.466 4.043 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.590 10.441 5.556 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -15.642 12.201 5.706 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.560 12.714 4.089 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -13.943 13.474 4.884 1.00 0.00 H new ATOM 496 N GLU A 152 -15.909 4.053 5.409 1.00 0.00 N ATOM 497 CA GLU A 152 -16.724 2.993 5.991 1.00 0.00 C ATOM 498 C GLU A 152 -16.009 1.644 6.082 1.00 0.00 C ATOM 499 O GLU A 152 -16.465 0.784 6.833 1.00 0.00 O ATOM 500 CB GLU A 152 -18.048 2.832 5.236 1.00 0.00 C ATOM 501 CG GLU A 152 -19.077 3.894 5.638 1.00 0.00 C ATOM 502 CD GLU A 152 -19.629 3.738 7.063 1.00 0.00 C ATOM 503 OE1 GLU A 152 -19.971 2.614 7.505 1.00 0.00 O ATOM 504 OE2 GLU A 152 -19.706 4.760 7.786 1.00 0.00 O ATOM 0 H GLU A 152 -16.285 4.415 4.532 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.924 3.313 7.014 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.863 2.896 4.164 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.457 1.840 5.431 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.619 4.879 5.545 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.909 3.861 4.934 1.00 0.00 H new ATOM 511 N ASN A 153 -14.921 1.433 5.342 1.00 0.00 N ATOM 512 CA ASN A 153 -14.147 0.186 5.345 1.00 0.00 C ATOM 513 C ASN A 153 -12.637 0.421 5.445 1.00 0.00 C ATOM 514 O ASN A 153 -11.877 -0.525 5.249 1.00 0.00 O ATOM 515 CB ASN A 153 -14.543 -0.765 4.191 1.00 0.00 C ATOM 516 CG ASN A 153 -14.959 -0.102 2.896 1.00 0.00 C ATOM 517 OD1 ASN A 153 -16.174 0.404 2.821 1.00 0.00 O flip ATOM 518 ND2 ASN A 153 -14.213 -0.092 1.926 1.00 0.00 N flip ATOM 0 H ASN A 153 -14.543 2.138 4.709 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.419 -0.336 6.262 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.699 -1.423 3.984 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -15.363 -1.396 4.533 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -13.276 -0.487 1.999 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -14.529 0.312 1.044 1.00 0.00 H new ATOM 525 N MET A 154 -12.169 1.619 5.820 1.00 0.00 N ATOM 526 CA MET A 154 -10.735 1.917 5.886 1.00 0.00 C ATOM 527 C MET A 154 -9.951 0.872 6.698 1.00 0.00 C ATOM 528 O MET A 154 -8.903 0.408 6.248 1.00 0.00 O ATOM 529 CB MET A 154 -10.465 3.359 6.364 1.00 0.00 C ATOM 530 CG MET A 154 -10.923 3.700 7.793 1.00 0.00 C ATOM 531 SD MET A 154 -10.199 5.200 8.523 1.00 0.00 S ATOM 532 CE MET A 154 -10.469 6.419 7.219 1.00 0.00 C ATOM 0 H MET A 154 -12.768 2.401 6.084 1.00 0.00 H new ATOM 0 HA MET A 154 -10.357 1.850 4.866 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.394 3.548 6.294 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.956 4.046 5.674 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.008 3.808 7.790 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.689 2.855 8.440 1.00 0.00 H new ATOM 0 HE1 MET A 154 -9.980 7.355 7.489 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.052 6.049 6.283 1.00 0.00 H new ATOM 0 HE3 MET A 154 -11.538 6.591 7.097 1.00 0.00 H new ATOM 542 N TYR A 155 -10.481 0.456 7.855 1.00 0.00 N ATOM 543 CA TYR A 155 -9.868 -0.483 8.794 1.00 0.00 C ATOM 544 C TYR A 155 -9.434 -1.793 8.132 1.00 0.00 C ATOM 545 O TYR A 155 -8.469 -2.419 8.566 1.00 0.00 O ATOM 546 CB TYR A 155 -10.870 -0.773 9.925 1.00 0.00 C ATOM 547 CG TYR A 155 -12.254 -1.204 9.458 1.00 0.00 C ATOM 548 CD1 TYR A 155 -12.508 -2.540 9.088 1.00 0.00 C ATOM 549 CD2 TYR A 155 -13.286 -0.252 9.360 1.00 0.00 C ATOM 550 CE1 TYR A 155 -13.758 -2.904 8.558 1.00 0.00 C ATOM 551 CE2 TYR A 155 -14.551 -0.619 8.879 1.00 0.00 C ATOM 552 CZ TYR A 155 -14.782 -1.939 8.433 1.00 0.00 C ATOM 553 OH TYR A 155 -15.975 -2.307 7.899 1.00 0.00 O ATOM 0 H TYR A 155 -11.393 0.783 8.174 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.962 -0.020 9.185 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -10.458 -1.554 10.564 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.972 0.122 10.539 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -11.739 -3.288 9.212 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -13.102 0.770 9.658 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -13.936 -3.923 8.246 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -15.349 0.108 8.850 1.00 0.00 H new ATOM 0 HH TYR A 155 -16.577 -1.534 7.880 1.00 0.00 H new ATOM 563 N ARG A 156 -10.160 -2.210 7.094 1.00 0.00 N ATOM 564 CA ARG A 156 -10.083 -3.513 6.452 1.00 0.00 C ATOM 565 C ARG A 156 -8.714 -3.722 5.790 1.00 0.00 C ATOM 566 O ARG A 156 -8.239 -4.849 5.671 1.00 0.00 O ATOM 567 CB ARG A 156 -11.274 -3.545 5.464 1.00 0.00 C ATOM 568 CG ARG A 156 -11.952 -4.896 5.244 1.00 0.00 C ATOM 569 CD ARG A 156 -13.285 -4.697 4.488 1.00 0.00 C ATOM 570 NE ARG A 156 -13.801 -5.972 3.973 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.776 -6.212 3.090 1.00 0.00 C ATOM 572 NH1 ARG A 156 -15.537 -5.249 2.596 1.00 0.00 N ATOM 573 NH2 ARG A 156 -14.980 -7.456 2.693 1.00 0.00 N ATOM 0 H ARG A 156 -10.857 -1.608 6.657 1.00 0.00 H new ATOM 0 HA ARG A 156 -10.161 -4.341 7.156 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -12.027 -2.841 5.817 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.924 -3.180 4.499 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -11.295 -5.554 4.675 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.136 -5.381 6.203 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.020 -4.247 5.155 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.137 -4.002 3.662 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.345 -6.804 4.347 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.390 -4.283 2.887 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.271 -5.473 1.924 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -14.399 -8.210 3.060 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -15.718 -7.662 2.020 1.00 0.00 H new ATOM 587 N TYR A 157 -8.090 -2.642 5.322 1.00 0.00 N ATOM 588 CA TYR A 157 -6.895 -2.618 4.493 1.00 0.00 C ATOM 589 C TYR A 157 -5.589 -2.889 5.242 1.00 0.00 C ATOM 590 O TYR A 157 -5.554 -2.817 6.475 1.00 0.00 O ATOM 591 CB TYR A 157 -6.866 -1.239 3.816 1.00 0.00 C ATOM 592 CG TYR A 157 -7.954 -1.069 2.778 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.232 -2.103 1.859 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.701 0.120 2.746 1.00 0.00 C ATOM 595 CE1 TYR A 157 -9.283 -1.972 0.945 1.00 0.00 C ATOM 596 CE2 TYR A 157 -9.733 0.274 1.808 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.037 -0.788 0.921 1.00 0.00 C ATOM 598 OH TYR A 157 -11.027 -0.693 0.004 1.00 0.00 O ATOM 0 H TYR A 157 -8.431 -1.703 5.527 1.00 0.00 H new ATOM 0 HA TYR A 157 -6.954 -3.435 3.774 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.972 -0.465 4.576 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -5.895 -1.092 3.344 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.630 -3.000 1.861 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.481 0.915 3.443 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -9.513 -2.777 0.262 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.292 1.197 1.762 1.00 0.00 H new ATOM 0 HH TYR A 157 -10.717 -1.058 -0.851 1.00 0.00 H new ATOM 608 N PRO A 158 -4.493 -3.168 4.503 1.00 0.00 N ATOM 609 CA PRO A 158 -3.169 -3.293 5.084 1.00 0.00 C ATOM 610 C PRO A 158 -2.714 -1.938 5.604 1.00 0.00 C ATOM 611 O PRO A 158 -3.183 -0.885 5.162 1.00 0.00 O ATOM 612 CB PRO A 158 -2.230 -3.789 3.978 1.00 0.00 C ATOM 613 CG PRO A 158 -2.935 -3.389 2.689 1.00 0.00 C ATOM 614 CD PRO A 158 -4.416 -3.348 3.059 1.00 0.00 C ATOM 0 HA PRO A 158 -3.168 -3.993 5.919 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.245 -3.328 4.054 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.082 -4.867 4.034 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.588 -2.419 2.332 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.745 -4.109 1.893 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.920 -2.531 2.542 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.914 -4.270 2.759 1.00 0.00 H new ATOM 622 N ASN A 159 -1.737 -1.956 6.503 1.00 0.00 N ATOM 623 CA ASN A 159 -1.002 -0.763 6.921 1.00 0.00 C ATOM 624 C ASN A 159 0.465 -0.888 6.566 1.00 0.00 C ATOM 625 O ASN A 159 1.154 0.126 6.604 1.00 0.00 O ATOM 626 CB ASN A 159 -1.116 -0.444 8.425 1.00 0.00 C ATOM 627 CG ASN A 159 -1.853 -1.472 9.250 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.036 -1.321 9.538 1.00 0.00 O ATOM 629 ND2 ASN A 159 -1.165 -2.541 9.613 1.00 0.00 N ATOM 0 H ASN A 159 -1.427 -2.809 6.969 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.468 0.060 6.379 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.111 -0.328 8.832 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.618 0.517 8.539 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -1.617 -3.279 10.153 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.183 -2.628 9.353 1.00 0.00 H new ATOM 636 N GLN A 160 0.959 -2.087 6.262 1.00 0.00 N ATOM 637 CA GLN A 160 2.346 -2.274 5.881 1.00 0.00 C ATOM 638 C GLN A 160 2.419 -2.542 4.383 1.00 0.00 C ATOM 639 O GLN A 160 1.408 -2.821 3.737 1.00 0.00 O ATOM 640 CB GLN A 160 2.996 -3.412 6.668 1.00 0.00 C ATOM 641 CG GLN A 160 2.554 -3.592 8.121 1.00 0.00 C ATOM 642 CD GLN A 160 3.356 -4.723 8.758 1.00 0.00 C ATOM 643 OE1 GLN A 160 3.191 -5.892 8.411 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.283 -4.412 9.649 1.00 0.00 N ATOM 0 H GLN A 160 0.409 -2.946 6.274 1.00 0.00 H new ATOM 0 HA GLN A 160 2.900 -1.366 6.117 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.803 -4.344 6.137 1.00 0.00 H new ATOM 0 HB3 GLN A 160 4.075 -3.257 6.659 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.706 -2.666 8.676 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.489 -3.818 8.163 1.00 0.00 H new ATOM 0 HE21 GLN A 160 4.413 -3.441 9.931 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.867 -5.144 10.054 1.00 0.00 H new ATOM 653 N VAL A 161 3.633 -2.472 3.857 1.00 0.00 N ATOM 654 CA VAL A 161 3.955 -2.223 2.465 1.00 0.00 C ATOM 655 C VAL A 161 5.284 -2.900 2.158 1.00 0.00 C ATOM 656 O VAL A 161 6.309 -2.566 2.760 1.00 0.00 O ATOM 657 CB VAL A 161 4.084 -0.703 2.249 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.721 -0.078 1.934 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.727 0.009 3.467 1.00 0.00 C ATOM 0 H VAL A 161 4.469 -2.596 4.428 1.00 0.00 H new ATOM 0 HA VAL A 161 3.177 -2.615 1.810 1.00 0.00 H new ATOM 0 HB VAL A 161 4.746 -0.561 1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.838 0.995 1.786 1.00 0.00 H new ATOM 0 HG12 VAL A 161 2.315 -0.527 1.027 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.038 -0.257 2.764 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.797 1.078 3.268 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.112 -0.156 4.351 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.725 -0.394 3.639 1.00 0.00 H new ATOM 669 N TYR A 162 5.264 -3.885 1.272 1.00 0.00 N ATOM 670 CA TYR A 162 6.470 -4.592 0.895 1.00 0.00 C ATOM 671 C TYR A 162 7.141 -3.842 -0.241 1.00 0.00 C ATOM 672 O TYR A 162 6.509 -3.652 -1.282 1.00 0.00 O ATOM 673 CB TYR A 162 6.119 -6.000 0.453 1.00 0.00 C ATOM 674 CG TYR A 162 5.599 -6.860 1.578 1.00 0.00 C ATOM 675 CD1 TYR A 162 6.520 -7.436 2.471 1.00 0.00 C ATOM 676 CD2 TYR A 162 4.213 -7.023 1.776 1.00 0.00 C ATOM 677 CE1 TYR A 162 6.051 -8.128 3.603 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.742 -7.761 2.871 1.00 0.00 C ATOM 679 CZ TYR A 162 4.658 -8.299 3.807 1.00 0.00 C ATOM 680 OH TYR A 162 4.208 -9.031 4.862 1.00 0.00 O ATOM 0 H TYR A 162 4.420 -4.211 0.801 1.00 0.00 H new ATOM 0 HA TYR A 162 7.149 -4.651 1.746 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.368 -5.950 -0.336 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.003 -6.470 0.022 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.581 -7.348 2.289 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.513 -6.579 1.084 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.754 -8.530 4.318 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.681 -7.919 3.000 1.00 0.00 H new ATOM 0 HH TYR A 162 3.228 -9.047 4.855 1.00 0.00 H new ATOM 690 N TYR A 163 8.409 -3.472 -0.076 1.00 0.00 N ATOM 691 CA TYR A 163 9.115 -2.680 -1.071 1.00 0.00 C ATOM 692 C TYR A 163 10.397 -3.403 -1.438 1.00 0.00 C ATOM 693 O TYR A 163 11.042 -3.982 -0.572 1.00 0.00 O ATOM 694 CB TYR A 163 9.351 -1.254 -0.551 1.00 0.00 C ATOM 695 CG TYR A 163 10.242 -1.095 0.675 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.696 -1.109 1.976 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.628 -0.890 0.514 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.535 -0.977 3.095 1.00 0.00 C ATOM 699 CE2 TYR A 163 12.468 -0.738 1.633 1.00 0.00 C ATOM 700 CZ TYR A 163 11.921 -0.793 2.933 1.00 0.00 C ATOM 701 OH TYR A 163 12.720 -0.715 4.035 1.00 0.00 O ATOM 0 H TYR A 163 8.968 -3.711 0.743 1.00 0.00 H new ATOM 0 HA TYR A 163 8.519 -2.572 -1.977 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.784 -0.667 -1.361 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.381 -0.814 -0.322 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.630 -1.221 2.112 1.00 0.00 H new ATOM 0 HD2 TYR A 163 12.050 -0.849 -0.479 1.00 0.00 H new ATOM 0 HE1 TYR A 163 10.113 -1.017 4.088 1.00 0.00 H new ATOM 0 HE2 TYR A 163 13.528 -0.580 1.497 1.00 0.00 H new ATOM 0 HH TYR A 163 13.651 -0.588 3.756 1.00 0.00 H new ATOM 711 N ARG A 164 10.796 -3.418 -2.708 1.00 0.00 N ATOM 712 CA ARG A 164 12.158 -3.853 -3.022 1.00 0.00 C ATOM 713 C ARG A 164 13.081 -2.678 -2.739 1.00 0.00 C ATOM 714 O ARG A 164 12.692 -1.543 -3.041 1.00 0.00 O ATOM 715 CB ARG A 164 12.265 -4.304 -4.470 1.00 0.00 C ATOM 716 CG ARG A 164 11.679 -5.713 -4.641 1.00 0.00 C ATOM 717 CD ARG A 164 12.741 -6.797 -4.442 1.00 0.00 C ATOM 718 NE ARG A 164 13.702 -6.747 -5.542 1.00 0.00 N ATOM 719 CZ ARG A 164 14.989 -7.076 -5.499 1.00 0.00 C ATOM 720 NH1 ARG A 164 15.502 -7.726 -4.460 1.00 0.00 N ATOM 721 NH2 ARG A 164 15.747 -6.732 -6.527 1.00 0.00 N ATOM 0 H ARG A 164 10.224 -3.146 -3.508 1.00 0.00 H new ATOM 0 HA ARG A 164 12.439 -4.710 -2.410 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.735 -3.603 -5.115 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.309 -4.298 -4.782 1.00 0.00 H new ATOM 0 HG2 ARG A 164 10.871 -5.860 -3.925 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.244 -5.808 -5.636 1.00 0.00 H new ATOM 0 HD2 ARG A 164 13.253 -6.649 -3.491 1.00 0.00 H new ATOM 0 HD3 ARG A 164 12.270 -7.779 -4.401 1.00 0.00 H new ATOM 0 HE ARG A 164 13.346 -6.424 -6.442 1.00 0.00 H new ATOM 0 HH11 ARG A 164 14.905 -7.983 -3.674 1.00 0.00 H new ATOM 0 HH12 ARG A 164 16.493 -7.968 -4.449 1.00 0.00 H new ATOM 0 HH21 ARG A 164 15.339 -6.232 -7.317 1.00 0.00 H new ATOM 0 HH22 ARG A 164 16.740 -6.967 -6.530 1.00 0.00 H new ATOM 735 N PRO A 165 14.265 -2.916 -2.157 1.00 0.00 N ATOM 736 CA PRO A 165 15.081 -1.818 -1.684 1.00 0.00 C ATOM 737 C PRO A 165 15.600 -0.971 -2.848 1.00 0.00 C ATOM 738 O PRO A 165 15.803 -1.482 -3.955 1.00 0.00 O ATOM 739 CB PRO A 165 16.188 -2.445 -0.830 1.00 0.00 C ATOM 740 CG PRO A 165 16.212 -3.928 -1.215 1.00 0.00 C ATOM 741 CD PRO A 165 14.849 -4.212 -1.847 1.00 0.00 C ATOM 0 HA PRO A 165 14.511 -1.115 -1.077 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.150 -1.973 -1.027 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.983 -2.319 0.233 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.020 -4.138 -1.916 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.377 -4.557 -0.340 1.00 0.00 H new ATOM 0 HD2 PRO A 165 14.956 -4.816 -2.748 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.212 -4.772 -1.162 1.00 0.00 H new ATOM 749 N VAL A 166 15.771 0.333 -2.614 1.00 0.00 N ATOM 750 CA VAL A 166 16.091 1.307 -3.649 1.00 0.00 C ATOM 751 C VAL A 166 17.560 1.225 -4.030 1.00 0.00 C ATOM 752 O VAL A 166 18.421 1.683 -3.278 1.00 0.00 O ATOM 753 CB VAL A 166 15.732 2.743 -3.218 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.306 3.064 -3.647 1.00 0.00 C ATOM 755 CG2 VAL A 166 15.898 3.064 -1.726 1.00 0.00 C ATOM 0 H VAL A 166 15.689 0.743 -1.684 1.00 0.00 H new ATOM 0 HA VAL A 166 15.485 1.061 -4.521 1.00 0.00 H new ATOM 0 HB VAL A 166 16.464 3.373 -3.723 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.054 4.079 -3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.225 2.980 -4.731 1.00 0.00 H new ATOM 0 HG13 VAL A 166 13.618 2.362 -3.176 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.616 4.101 -1.543 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.258 2.405 -1.139 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.938 2.914 -1.435 1.00 0.00 H new ATOM 765 N ASP A 167 17.836 0.688 -5.216 1.00 0.00 N ATOM 766 CA ASP A 167 19.128 0.833 -5.867 1.00 0.00 C ATOM 767 C ASP A 167 18.961 0.819 -7.372 1.00 0.00 C ATOM 768 O ASP A 167 19.671 1.555 -8.057 1.00 0.00 O ATOM 769 CB ASP A 167 20.111 -0.287 -5.494 1.00 0.00 C ATOM 770 CG ASP A 167 20.835 -0.029 -4.180 1.00 0.00 C ATOM 771 OD1 ASP A 167 21.823 0.743 -4.168 1.00 0.00 O ATOM 772 OD2 ASP A 167 20.469 -0.648 -3.159 1.00 0.00 O ATOM 0 H ASP A 167 17.164 0.138 -5.752 1.00 0.00 H new ATOM 0 HA ASP A 167 19.535 1.784 -5.523 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.569 -1.230 -5.425 1.00 0.00 H new ATOM 0 HB3 ASP A 167 20.846 -0.399 -6.291 1.00 0.00 H new ATOM 777 N GLN A 168 18.066 -0.010 -7.910 1.00 0.00 N ATOM 778 CA GLN A 168 18.048 -0.374 -9.320 1.00 0.00 C ATOM 779 C GLN A 168 16.748 0.018 -10.018 1.00 0.00 C ATOM 780 O GLN A 168 16.749 0.106 -11.244 1.00 0.00 O ATOM 781 CB GLN A 168 18.287 -1.888 -9.452 1.00 0.00 C ATOM 782 CG GLN A 168 19.652 -2.383 -8.944 1.00 0.00 C ATOM 783 CD GLN A 168 20.811 -1.769 -9.722 1.00 0.00 C ATOM 784 OE1 GLN A 168 21.158 -2.208 -10.819 1.00 0.00 O ATOM 785 NE2 GLN A 168 21.410 -0.711 -9.206 1.00 0.00 N ATOM 0 H GLN A 168 17.324 -0.452 -7.367 1.00 0.00 H new ATOM 0 HA GLN A 168 18.844 0.182 -9.815 1.00 0.00 H new ATOM 0 HB2 GLN A 168 17.502 -2.412 -8.906 1.00 0.00 H new ATOM 0 HB3 GLN A 168 18.186 -2.165 -10.501 1.00 0.00 H new ATOM 0 HG2 GLN A 168 19.755 -2.138 -7.887 1.00 0.00 H new ATOM 0 HG3 GLN A 168 19.696 -3.469 -9.025 1.00 0.00 H new ATOM 0 HE21 GLN A 168 21.118 -0.352 -8.297 1.00 0.00 H new ATOM 0 HE22 GLN A 168 22.165 -0.253 -9.717 1.00 0.00 H new ATOM 794 N ALA A 169 15.657 0.255 -9.288 1.00 0.00 N ATOM 795 CA ALA A 169 14.349 0.577 -9.865 1.00 0.00 C ATOM 796 C ALA A 169 13.720 1.821 -9.231 1.00 0.00 C ATOM 797 O ALA A 169 12.531 2.063 -9.394 1.00 0.00 O ATOM 798 CB ALA A 169 13.420 -0.634 -9.757 1.00 0.00 C ATOM 0 H ALA A 169 15.656 0.229 -8.268 1.00 0.00 H new ATOM 0 HA ALA A 169 14.499 0.815 -10.918 1.00 0.00 H new ATOM 0 HB1 ALA A 169 12.450 -0.388 -10.188 1.00 0.00 H new ATOM 0 HB2 ALA A 169 13.854 -1.475 -10.298 1.00 0.00 H new ATOM 0 HB3 ALA A 169 13.294 -0.903 -8.708 1.00 0.00 H new ATOM 804 N SER A 170 14.505 2.608 -8.502 1.00 0.00 N ATOM 805 CA SER A 170 14.164 3.769 -7.706 1.00 0.00 C ATOM 806 C SER A 170 13.411 4.810 -8.542 1.00 0.00 C ATOM 807 O SER A 170 14.016 5.687 -9.171 1.00 0.00 O ATOM 808 CB SER A 170 15.459 4.325 -7.076 1.00 0.00 C ATOM 809 OG SER A 170 16.430 3.297 -6.877 1.00 0.00 O ATOM 0 H SER A 170 15.507 2.421 -8.454 1.00 0.00 H new ATOM 0 HA SER A 170 13.482 3.491 -6.903 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.875 5.099 -7.721 1.00 0.00 H new ATOM 0 HB3 SER A 170 15.227 4.797 -6.121 1.00 0.00 H new ATOM 0 HG SER A 170 17.238 3.683 -6.479 1.00 0.00 H new ATOM 815 N ASN A 171 12.087 4.669 -8.597 1.00 0.00 N ATOM 816 CA ASN A 171 11.188 5.661 -9.186 1.00 0.00 C ATOM 817 C ASN A 171 9.805 5.666 -8.541 1.00 0.00 C ATOM 818 O ASN A 171 9.288 4.615 -8.171 1.00 0.00 O ATOM 819 CB ASN A 171 11.027 5.425 -10.689 1.00 0.00 C ATOM 820 CG ASN A 171 10.828 6.716 -11.466 1.00 0.00 C ATOM 821 OD1 ASN A 171 10.762 7.808 -10.902 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.699 6.589 -12.772 1.00 0.00 N ATOM 0 H ASN A 171 11.602 3.851 -8.228 1.00 0.00 H new ATOM 0 HA ASN A 171 11.652 6.630 -9.002 1.00 0.00 H new ATOM 0 HB2 ASN A 171 11.909 4.909 -11.068 1.00 0.00 H new ATOM 0 HB3 ASN A 171 10.175 4.767 -10.860 1.00 0.00 H new ATOM 0 HD21 ASN A 171 10.538 7.413 -13.351 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.760 5.667 -13.203 1.00 0.00 H new ATOM 829 N GLN A 172 9.143 6.821 -8.536 1.00 0.00 N ATOM 830 CA GLN A 172 7.867 7.094 -7.859 1.00 0.00 C ATOM 831 C GLN A 172 6.666 6.640 -8.709 1.00 0.00 C ATOM 832 O GLN A 172 5.508 6.756 -8.298 1.00 0.00 O ATOM 833 CB GLN A 172 7.835 8.579 -7.432 1.00 0.00 C ATOM 834 CG GLN A 172 6.525 9.083 -6.799 1.00 0.00 C ATOM 835 CD GLN A 172 6.743 10.277 -5.866 1.00 0.00 C ATOM 836 OE1 GLN A 172 6.799 11.422 -6.311 1.00 0.00 O ATOM 837 NE2 GLN A 172 6.839 10.056 -4.565 1.00 0.00 N ATOM 0 H GLN A 172 9.498 7.640 -9.030 1.00 0.00 H new ATOM 0 HA GLN A 172 7.784 6.500 -6.949 1.00 0.00 H new ATOM 0 HB2 GLN A 172 8.644 8.747 -6.721 1.00 0.00 H new ATOM 0 HB3 GLN A 172 8.048 9.191 -8.309 1.00 0.00 H new ATOM 0 HG2 GLN A 172 5.830 9.366 -7.589 1.00 0.00 H new ATOM 0 HG3 GLN A 172 6.060 8.271 -6.241 1.00 0.00 H new ATOM 0 HE21 GLN A 172 6.791 9.103 -4.205 1.00 0.00 H new ATOM 0 HE22 GLN A 172 6.960 10.839 -3.922 1.00 0.00 H new ATOM 846 N ASN A 173 6.929 6.091 -9.893 1.00 0.00 N ATOM 847 CA ASN A 173 6.019 5.206 -10.601 1.00 0.00 C ATOM 848 C ASN A 173 6.308 3.774 -10.164 1.00 0.00 C ATOM 849 O ASN A 173 5.443 3.102 -9.617 1.00 0.00 O ATOM 850 CB ASN A 173 6.205 5.354 -12.117 1.00 0.00 C ATOM 851 CG ASN A 173 5.017 6.031 -12.785 1.00 0.00 C ATOM 852 OD1 ASN A 173 3.990 5.412 -13.050 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.135 7.299 -13.136 1.00 0.00 N ATOM 0 H ASN A 173 7.802 6.256 -10.395 1.00 0.00 H new ATOM 0 HA ASN A 173 4.987 5.464 -10.365 1.00 0.00 H new ATOM 0 HB2 ASN A 173 7.107 5.933 -12.315 1.00 0.00 H new ATOM 0 HB3 ASN A 173 6.354 4.369 -12.560 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.373 7.765 -13.628 1.00 0.00 H new ATOM 0 HD22 ASN A 173 5.989 7.812 -12.915 1.00 0.00 H new ATOM 860 N ASN A 174 7.528 3.279 -10.406 1.00 0.00 N ATOM 861 CA ASN A 174 7.686 1.834 -10.545 1.00 0.00 C ATOM 862 C ASN A 174 8.056 1.099 -9.249 1.00 0.00 C ATOM 863 O ASN A 174 7.600 -0.028 -9.057 1.00 0.00 O ATOM 864 CB ASN A 174 8.596 1.506 -11.729 1.00 0.00 C ATOM 865 CG ASN A 174 10.048 1.341 -11.373 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.458 0.271 -10.953 1.00 0.00 O ATOM 867 ND2 ASN A 174 10.841 2.371 -11.601 1.00 0.00 N ATOM 0 H ASN A 174 8.381 3.830 -10.505 1.00 0.00 H new ATOM 0 HA ASN A 174 6.698 1.432 -10.769 1.00 0.00 H new ATOM 0 HB2 ASN A 174 8.243 0.588 -12.198 1.00 0.00 H new ATOM 0 HB3 ASN A 174 8.505 2.299 -12.472 1.00 0.00 H new ATOM 0 HD21 ASN A 174 11.843 2.292 -11.426 1.00 0.00 H new ATOM 0 HD22 ASN A 174 10.452 3.246 -11.952 1.00 0.00 H new ATOM 874 N PHE A 175 8.752 1.750 -8.310 1.00 0.00 N ATOM 875 CA PHE A 175 8.880 1.261 -6.932 1.00 0.00 C ATOM 876 C PHE A 175 7.481 1.094 -6.336 1.00 0.00 C ATOM 877 O PHE A 175 7.188 0.107 -5.656 1.00 0.00 O ATOM 878 CB PHE A 175 9.705 2.264 -6.102 1.00 0.00 C ATOM 879 CG PHE A 175 9.818 2.015 -4.606 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.769 2.390 -3.741 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.014 1.518 -4.057 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.920 2.283 -2.348 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.159 1.403 -2.662 1.00 0.00 C ATOM 884 CZ PHE A 175 10.125 1.813 -1.806 1.00 0.00 C ATOM 0 H PHE A 175 9.241 2.628 -8.483 1.00 0.00 H new ATOM 0 HA PHE A 175 9.393 0.299 -6.920 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.713 2.293 -6.515 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.273 3.254 -6.246 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.842 2.762 -4.152 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.824 1.224 -4.708 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.107 2.563 -1.694 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.070 0.997 -2.248 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.257 1.767 -0.735 1.00 0.00 H new ATOM 894 N VAL A 176 6.633 2.093 -6.595 1.00 0.00 N ATOM 895 CA VAL A 176 5.266 2.208 -6.119 1.00 0.00 C ATOM 896 C VAL A 176 4.399 1.131 -6.791 1.00 0.00 C ATOM 897 O VAL A 176 3.570 0.542 -6.102 1.00 0.00 O ATOM 898 CB VAL A 176 4.804 3.668 -6.362 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.349 3.974 -6.004 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.672 4.654 -5.560 1.00 0.00 C ATOM 0 H VAL A 176 6.905 2.885 -7.177 1.00 0.00 H new ATOM 0 HA VAL A 176 5.174 2.020 -5.049 1.00 0.00 H new ATOM 0 HB VAL A 176 4.910 3.787 -7.440 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.135 5.022 -6.214 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.688 3.343 -6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.185 3.775 -4.945 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.331 5.673 -5.745 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.588 4.431 -4.496 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.713 4.558 -5.870 1.00 0.00 H new ATOM 910 N HIS A 177 4.619 0.808 -8.071 1.00 0.00 N ATOM 911 CA HIS A 177 3.856 -0.186 -8.821 1.00 0.00 C ATOM 912 C HIS A 177 4.001 -1.545 -8.144 1.00 0.00 C ATOM 913 O HIS A 177 3.022 -2.135 -7.696 1.00 0.00 O ATOM 914 CB HIS A 177 4.356 -0.223 -10.279 1.00 0.00 C ATOM 915 CG HIS A 177 3.662 -1.187 -11.217 1.00 0.00 C ATOM 916 ND1 HIS A 177 3.994 -1.377 -12.542 1.00 0.00 N ATOM 917 CD2 HIS A 177 2.614 -2.023 -10.943 1.00 0.00 C ATOM 918 CE1 HIS A 177 3.159 -2.290 -13.062 1.00 0.00 C ATOM 919 NE2 HIS A 177 2.324 -2.737 -12.111 1.00 0.00 N ATOM 0 H HIS A 177 5.355 1.246 -8.626 1.00 0.00 H new ATOM 0 HA HIS A 177 2.798 0.077 -8.834 1.00 0.00 H new ATOM 0 HB2 HIS A 177 4.264 0.780 -10.695 1.00 0.00 H new ATOM 0 HB3 HIS A 177 5.418 -0.467 -10.267 1.00 0.00 H new ATOM 0 HD1 HIS A 177 4.747 -0.904 -13.042 1.00 0.00 H new ATOM 0 HD2 HIS A 177 2.103 -2.115 -9.996 1.00 0.00 H new ATOM 0 HE1 HIS A 177 3.159 -2.616 -14.092 1.00 0.00 H new ATOM 927 N ASP A 178 5.227 -2.056 -8.076 1.00 0.00 N ATOM 928 CA ASP A 178 5.523 -3.380 -7.543 1.00 0.00 C ATOM 929 C ASP A 178 5.133 -3.478 -6.060 1.00 0.00 C ATOM 930 O ASP A 178 4.628 -4.508 -5.612 1.00 0.00 O ATOM 931 CB ASP A 178 7.011 -3.670 -7.771 1.00 0.00 C ATOM 932 CG ASP A 178 7.322 -5.169 -7.855 1.00 0.00 C ATOM 933 OD1 ASP A 178 6.761 -5.990 -7.098 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.100 -5.561 -8.756 1.00 0.00 O ATOM 0 H ASP A 178 6.055 -1.553 -8.395 1.00 0.00 H new ATOM 0 HA ASP A 178 4.932 -4.134 -8.062 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.333 -3.185 -8.693 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.590 -3.229 -6.960 1.00 0.00 H new ATOM 939 N CYS A 179 5.298 -2.385 -5.303 1.00 0.00 N ATOM 940 CA CYS A 179 4.853 -2.306 -3.917 1.00 0.00 C ATOM 941 C CYS A 179 3.330 -2.425 -3.819 1.00 0.00 C ATOM 942 O CYS A 179 2.856 -3.229 -3.013 1.00 0.00 O ATOM 943 CB CYS A 179 5.356 -1.011 -3.265 1.00 0.00 C ATOM 944 SG CYS A 179 4.909 -0.848 -1.519 1.00 0.00 S ATOM 0 H CYS A 179 5.745 -1.533 -5.641 1.00 0.00 H new ATOM 0 HA CYS A 179 5.281 -3.147 -3.371 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.441 -0.967 -3.358 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.954 -0.159 -3.814 1.00 0.00 H new ATOM 949 N VAL A 180 2.566 -1.673 -4.628 1.00 0.00 N ATOM 950 CA VAL A 180 1.113 -1.811 -4.744 1.00 0.00 C ATOM 951 C VAL A 180 0.803 -3.269 -5.043 1.00 0.00 C ATOM 952 O VAL A 180 0.129 -3.904 -4.239 1.00 0.00 O ATOM 953 CB VAL A 180 0.510 -0.774 -5.738 1.00 0.00 C ATOM 954 CG1 VAL A 180 -0.618 -1.282 -6.643 1.00 0.00 C ATOM 955 CG2 VAL A 180 -0.071 0.419 -4.963 1.00 0.00 C ATOM 0 H VAL A 180 2.950 -0.942 -5.227 1.00 0.00 H new ATOM 0 HA VAL A 180 0.615 -1.564 -3.806 1.00 0.00 H new ATOM 0 HB VAL A 180 1.354 -0.518 -6.379 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.957 -0.473 -7.290 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -0.251 -2.106 -7.254 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.449 -1.628 -6.029 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.491 1.139 -5.665 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.854 0.069 -4.290 1.00 0.00 H new ATOM 0 HG23 VAL A 180 0.719 0.896 -4.383 1.00 0.00 H new ATOM 965 N ASN A 181 1.353 -3.812 -6.127 1.00 0.00 N ATOM 966 CA ASN A 181 1.086 -5.151 -6.626 1.00 0.00 C ATOM 967 C ASN A 181 1.217 -6.184 -5.517 1.00 0.00 C ATOM 968 O ASN A 181 0.265 -6.919 -5.242 1.00 0.00 O ATOM 969 CB ASN A 181 2.065 -5.493 -7.757 1.00 0.00 C ATOM 970 CG ASN A 181 1.736 -4.859 -9.092 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.644 -4.352 -9.320 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.671 -4.905 -10.023 1.00 0.00 N ATOM 0 H ASN A 181 2.025 -3.306 -6.703 1.00 0.00 H new ATOM 0 HA ASN A 181 0.064 -5.173 -7.004 1.00 0.00 H new ATOM 0 HB2 ASN A 181 3.066 -5.181 -7.459 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.092 -6.576 -7.881 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.489 -4.515 -10.948 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.575 -5.330 -9.817 1.00 0.00 H new ATOM 979 N ILE A 182 2.403 -6.282 -4.911 1.00 0.00 N ATOM 980 CA ILE A 182 2.667 -7.246 -3.857 1.00 0.00 C ATOM 981 C ILE A 182 1.744 -6.999 -2.669 1.00 0.00 C ATOM 982 O ILE A 182 1.158 -7.960 -2.180 1.00 0.00 O ATOM 983 CB ILE A 182 4.167 -7.232 -3.464 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.091 -8.153 -4.297 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.379 -7.624 -2.001 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.479 -9.450 -4.826 1.00 0.00 C ATOM 0 H ILE A 182 3.203 -5.692 -5.142 1.00 0.00 H new ATOM 0 HA ILE A 182 2.451 -8.249 -4.226 1.00 0.00 H new ATOM 0 HB ILE A 182 4.446 -6.197 -3.662 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.462 -7.581 -5.148 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.955 -8.411 -3.684 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.444 -7.601 -1.769 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.852 -6.921 -1.356 1.00 0.00 H new ATOM 0 HG23 ILE A 182 3.993 -8.630 -1.834 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.229 -10.002 -5.392 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.135 -10.058 -3.989 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.635 -9.216 -5.475 1.00 0.00 H new ATOM 998 N THR A 183 1.671 -5.773 -2.155 1.00 0.00 N ATOM 999 CA THR A 183 0.978 -5.507 -0.901 1.00 0.00 C ATOM 1000 C THR A 183 -0.511 -5.835 -1.081 1.00 0.00 C ATOM 1001 O THR A 183 -1.115 -6.467 -0.214 1.00 0.00 O ATOM 1002 CB THR A 183 1.260 -4.053 -0.500 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.660 -3.858 -0.382 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.595 -3.667 0.818 1.00 0.00 C ATOM 0 H THR A 183 2.085 -4.948 -2.590 1.00 0.00 H new ATOM 0 HA THR A 183 1.332 -6.136 -0.084 1.00 0.00 H new ATOM 0 HB THR A 183 0.841 -3.418 -1.281 1.00 0.00 H new ATOM 0 HG1 THR A 183 3.029 -3.603 -1.253 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.828 -2.628 1.053 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.485 -3.785 0.729 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.966 -4.311 1.615 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.081 -5.529 -2.251 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.392 -6.005 -2.658 1.00 0.00 C ATOM 1014 C ILE A 184 -2.436 -7.518 -2.619 1.00 0.00 C ATOM 1015 O ILE A 184 -3.325 -8.067 -1.990 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.783 -5.389 -4.020 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.626 -4.162 -3.658 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.497 -6.304 -5.024 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.978 -3.267 -4.822 1.00 0.00 C ATOM 0 H ILE A 184 -0.632 -4.934 -2.947 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.152 -5.670 -1.952 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.873 -5.157 -4.573 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.549 -4.500 -3.186 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -3.085 -3.574 -2.917 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -3.713 -5.746 -5.935 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -2.856 -7.153 -5.262 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.429 -6.664 -4.589 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.575 -2.427 -4.467 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -3.064 -2.894 -5.283 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.550 -3.834 -5.557 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.489 -8.232 -3.218 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.501 -9.691 -3.189 1.00 0.00 C ATOM 1033 C LYS A 185 -1.551 -10.232 -1.747 1.00 0.00 C ATOM 1034 O LYS A 185 -2.229 -11.218 -1.467 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.302 -10.190 -4.001 1.00 0.00 C ATOM 1036 CG LYS A 185 -0.565 -11.585 -4.563 1.00 0.00 C ATOM 1037 CD LYS A 185 0.533 -11.988 -5.557 1.00 0.00 C ATOM 1038 CE LYS A 185 -0.011 -12.588 -6.860 1.00 0.00 C ATOM 1039 NZ LYS A 185 -0.865 -13.770 -6.646 1.00 0.00 N ATOM 0 H LYS A 185 -0.705 -7.826 -3.729 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.409 -10.078 -3.651 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.098 -9.498 -4.818 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.586 -10.210 -3.370 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -0.608 -12.308 -3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -1.536 -11.605 -5.058 1.00 0.00 H new ATOM 0 HD2 LYS A 185 1.137 -11.112 -5.794 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.195 -12.712 -5.081 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.582 -11.827 -7.391 1.00 0.00 H new ATOM 0 HE3 LYS A 185 0.826 -12.864 -7.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -1.145 -14.167 -7.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.338 -14.485 -6.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -1.716 -13.492 -6.116 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.936 -9.528 -0.803 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.809 -9.853 0.602 1.00 0.00 C ATOM 1055 C GLN A 186 -1.970 -9.265 1.414 1.00 0.00 C ATOM 1056 O GLN A 186 -1.935 -9.312 2.643 1.00 0.00 O ATOM 1057 CB GLN A 186 0.578 -9.417 1.111 1.00 0.00 C ATOM 1058 CG GLN A 186 1.768 -10.068 0.376 1.00 0.00 C ATOM 1059 CD GLN A 186 1.519 -11.470 -0.191 1.00 0.00 C ATOM 1060 OE1 GLN A 186 1.167 -12.405 0.523 1.00 0.00 O ATOM 1061 NE2 GLN A 186 1.738 -11.649 -1.485 1.00 0.00 N ATOM 0 H GLN A 186 -0.478 -8.644 -1.025 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.877 -10.933 0.736 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.660 -8.334 1.019 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.651 -9.653 2.173 1.00 0.00 H new ATOM 0 HG2 GLN A 186 2.066 -9.414 -0.443 1.00 0.00 H new ATOM 0 HG3 GLN A 186 2.611 -10.120 1.065 1.00 0.00 H new ATOM 0 HE21 GLN A 186 2.030 -10.863 -2.066 1.00 0.00 H new ATOM 0 HE22 GLN A 186 1.615 -12.572 -1.900 1.00 0.00 H new ATOM 1070 N HIS A 187 -3.024 -8.791 0.747 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.330 -8.499 1.314 1.00 0.00 C ATOM 1072 C HIS A 187 -5.498 -8.962 0.428 1.00 0.00 C ATOM 1073 O HIS A 187 -6.644 -8.885 0.855 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.424 -7.007 1.638 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.609 -6.799 3.118 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.770 -6.491 3.795 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.616 -6.943 4.043 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.467 -6.419 5.104 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -4.167 -6.703 5.305 1.00 0.00 N ATOM 0 H HIS A 187 -2.982 -8.593 -0.253 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.424 -9.076 2.234 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -3.520 -6.499 1.304 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.258 -6.563 1.095 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.690 -6.345 3.380 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.587 -7.197 3.837 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.170 -6.168 5.885 1.00 0.00 H new ATOM 1087 N THR A 188 -5.225 -9.501 -0.759 1.00 0.00 N ATOM 1088 CA THR A 188 -6.196 -9.906 -1.776 1.00 0.00 C ATOM 1089 C THR A 188 -6.122 -11.415 -2.013 1.00 0.00 C ATOM 1090 O THR A 188 -6.904 -11.989 -2.774 1.00 0.00 O ATOM 1091 CB THR A 188 -6.055 -9.033 -3.036 1.00 0.00 C ATOM 1092 OG1 THR A 188 -6.130 -7.673 -2.661 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.170 -9.217 -4.065 1.00 0.00 C ATOM 0 H THR A 188 -4.265 -9.677 -1.054 1.00 0.00 H new ATOM 0 HA THR A 188 -7.212 -9.725 -1.424 1.00 0.00 H new ATOM 0 HB THR A 188 -5.106 -9.332 -3.482 1.00 0.00 H new ATOM 0 HG1 THR A 188 -5.229 -7.333 -2.481 1.00 0.00 H new ATOM 0 HG21 THR A 188 -6.989 -8.563 -4.918 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.189 -10.254 -4.400 1.00 0.00 H new ATOM 0 HG23 THR A 188 -8.129 -8.965 -3.612 1.00 0.00 H new ATOM 1101 N VAL A 189 -5.223 -12.085 -1.297 1.00 0.00 N ATOM 1102 CA VAL A 189 -5.112 -13.523 -1.307 1.00 0.00 C ATOM 1103 C VAL A 189 -4.773 -14.008 0.093 1.00 0.00 C ATOM 1104 O VAL A 189 -5.503 -14.842 0.619 1.00 0.00 O ATOM 1105 CB VAL A 189 -4.132 -13.924 -2.426 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -2.741 -14.366 -1.987 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -4.782 -15.007 -3.283 1.00 0.00 C ATOM 0 H VAL A 189 -4.545 -11.628 -0.687 1.00 0.00 H new ATOM 0 HA VAL A 189 -6.050 -14.024 -1.549 1.00 0.00 H new ATOM 0 HB VAL A 189 -3.947 -13.008 -2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -2.147 -14.622 -2.864 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.256 -13.555 -1.444 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -2.824 -15.238 -1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -4.098 -15.300 -4.080 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -5.009 -15.874 -2.663 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.703 -14.621 -3.719 1.00 0.00 H new ATOM 1117 N THR A 190 -3.754 -13.445 0.756 1.00 0.00 N ATOM 1118 CA THR A 190 -3.306 -14.059 2.030 1.00 0.00 C ATOM 1119 C THR A 190 -4.243 -13.708 3.219 1.00 0.00 C ATOM 1120 O THR A 190 -3.922 -13.961 4.381 1.00 0.00 O ATOM 1121 CB THR A 190 -1.800 -13.796 2.263 1.00 0.00 C ATOM 1122 OG1 THR A 190 -1.183 -14.764 3.100 1.00 0.00 O ATOM 1123 CG2 THR A 190 -1.549 -12.428 2.880 1.00 0.00 C ATOM 0 H THR A 190 -3.244 -12.613 0.461 1.00 0.00 H new ATOM 0 HA THR A 190 -3.398 -15.142 1.954 1.00 0.00 H new ATOM 0 HB THR A 190 -1.358 -13.852 1.268 1.00 0.00 H new ATOM 0 HG1 THR A 190 -0.234 -14.545 3.208 1.00 0.00 H new ATOM 0 HG21 THR A 190 -0.478 -12.286 3.026 1.00 0.00 H new ATOM 0 HG22 THR A 190 -1.931 -11.653 2.215 1.00 0.00 H new ATOM 0 HG23 THR A 190 -2.058 -12.364 3.842 1.00 0.00 H new ATOM 1131 N THR A 191 -5.411 -13.137 2.937 1.00 0.00 N ATOM 1132 CA THR A 191 -6.321 -12.506 3.888 1.00 0.00 C ATOM 1133 C THR A 191 -7.753 -12.855 3.464 1.00 0.00 C ATOM 1134 O THR A 191 -8.538 -13.386 4.250 1.00 0.00 O ATOM 1135 CB THR A 191 -6.034 -10.990 3.861 1.00 0.00 C ATOM 1136 OG1 THR A 191 -4.641 -10.764 3.950 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.716 -10.237 4.990 1.00 0.00 C ATOM 0 H THR A 191 -5.768 -13.100 1.982 1.00 0.00 H new ATOM 0 HA THR A 191 -6.186 -12.855 4.912 1.00 0.00 H new ATOM 0 HB THR A 191 -6.434 -10.616 2.919 1.00 0.00 H new ATOM 0 HG1 THR A 191 -4.477 -9.845 4.248 1.00 0.00 H new ATOM 0 HG21 THR A 191 -6.476 -9.176 4.917 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.795 -10.371 4.917 1.00 0.00 H new ATOM 0 HG23 THR A 191 -6.367 -10.623 5.948 1.00 0.00 H new ATOM 1145 N THR A 192 -8.046 -12.669 2.179 1.00 0.00 N ATOM 1146 CA THR A 192 -9.311 -12.855 1.471 1.00 0.00 C ATOM 1147 C THR A 192 -9.768 -14.318 1.383 1.00 0.00 C ATOM 1148 O THR A 192 -10.719 -14.639 0.679 1.00 0.00 O ATOM 1149 CB THR A 192 -9.116 -12.276 0.060 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.158 -11.243 0.108 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.368 -11.681 -0.579 1.00 0.00 C ATOM 0 H THR A 192 -7.321 -12.348 1.537 1.00 0.00 H new ATOM 0 HA THR A 192 -10.098 -12.346 2.027 1.00 0.00 H new ATOM 0 HB THR A 192 -8.811 -13.127 -0.548 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.423 -10.582 0.782 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.124 -11.300 -1.571 1.00 0.00 H new ATOM 0 HG22 THR A 192 -11.134 -12.451 -0.664 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.741 -10.866 0.041 1.00 0.00 H new ATOM 1159 N THR A 193 -9.050 -15.226 2.027 1.00 0.00 N ATOM 1160 CA THR A 193 -9.451 -16.615 2.180 1.00 0.00 C ATOM 1161 C THR A 193 -9.110 -17.109 3.605 1.00 0.00 C ATOM 1162 O THR A 193 -9.117 -18.305 3.892 1.00 0.00 O ATOM 1163 CB THR A 193 -8.856 -17.388 0.983 1.00 0.00 C ATOM 1164 OG1 THR A 193 -9.573 -18.568 0.686 1.00 0.00 O ATOM 1165 CG2 THR A 193 -7.361 -17.710 1.117 1.00 0.00 C ATOM 0 H THR A 193 -8.155 -15.013 2.466 1.00 0.00 H new ATOM 0 HA THR A 193 -10.527 -16.780 2.130 1.00 0.00 H new ATOM 0 HB THR A 193 -8.959 -16.692 0.150 1.00 0.00 H new ATOM 0 HG1 THR A 193 -9.158 -19.019 -0.079 1.00 0.00 H new ATOM 0 HG21 THR A 193 -7.025 -18.253 0.234 1.00 0.00 H new ATOM 0 HG22 THR A 193 -6.796 -16.783 1.209 1.00 0.00 H new ATOM 0 HG23 THR A 193 -7.199 -18.323 2.004 1.00 0.00 H new ATOM 1173 N LYS A 194 -8.820 -16.185 4.535 1.00 0.00 N ATOM 1174 CA LYS A 194 -8.419 -16.446 5.921 1.00 0.00 C ATOM 1175 C LYS A 194 -9.277 -15.673 6.926 1.00 0.00 C ATOM 1176 O LYS A 194 -8.920 -15.621 8.103 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.934 -16.116 6.132 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.998 -16.785 5.119 1.00 0.00 C ATOM 1179 CD LYS A 194 -4.594 -16.886 5.720 1.00 0.00 C ATOM 1180 CE LYS A 194 -3.565 -17.104 4.615 1.00 0.00 C ATOM 1181 NZ LYS A 194 -2.226 -17.364 5.173 1.00 0.00 N ATOM 0 H LYS A 194 -8.862 -15.187 4.327 1.00 0.00 H new ATOM 0 HA LYS A 194 -8.577 -17.510 6.100 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.801 -15.036 6.076 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -6.643 -16.422 7.137 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.369 -17.777 4.863 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.970 -16.207 4.195 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -4.360 -15.975 6.271 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -4.554 -17.710 6.433 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.871 -17.944 3.991 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -3.528 -16.225 3.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -1.549 -17.508 4.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.926 -16.551 5.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -2.257 -18.216 5.768 1.00 0.00 H new ATOM 1195 N GLY A 195 -10.362 -15.032 6.491 1.00 0.00 N ATOM 1196 CA GLY A 195 -11.186 -14.200 7.358 1.00 0.00 C ATOM 1197 C GLY A 195 -11.852 -13.048 6.618 1.00 0.00 C ATOM 1198 O GLY A 195 -12.750 -12.425 7.187 1.00 0.00 O ATOM 0 H GLY A 195 -10.692 -15.077 5.527 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.954 -14.818 7.823 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -10.569 -13.800 8.162 1.00 0.00 H new ATOM 1202 N GLU A 196 -11.463 -12.774 5.371 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.981 -11.675 4.558 1.00 0.00 C ATOM 1204 C GLU A 196 -12.540 -12.190 3.232 1.00 0.00 C ATOM 1205 O GLU A 196 -12.239 -13.316 2.842 1.00 0.00 O ATOM 1206 CB GLU A 196 -10.834 -10.670 4.305 1.00 0.00 C ATOM 1207 CG GLU A 196 -11.046 -9.361 5.074 1.00 0.00 C ATOM 1208 CD GLU A 196 -12.386 -8.723 4.717 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -12.800 -8.824 3.544 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -13.083 -8.164 5.595 1.00 0.00 O ATOM 0 H GLU A 196 -10.758 -13.328 4.886 1.00 0.00 H new ATOM 0 HA GLU A 196 -12.797 -11.185 5.089 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.886 -11.118 4.603 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.765 -10.458 3.238 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -11.007 -9.555 6.146 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.237 -8.667 4.846 1.00 0.00 H new ATOM 1217 N ASN A 197 -13.284 -11.342 2.515 1.00 0.00 N ATOM 1218 CA ASN A 197 -13.725 -11.525 1.136 1.00 0.00 C ATOM 1219 C ASN A 197 -13.971 -10.151 0.497 1.00 0.00 C ATOM 1220 O ASN A 197 -15.105 -9.756 0.209 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.964 -12.422 1.049 1.00 0.00 C ATOM 1222 CG ASN A 197 -15.136 -13.015 -0.350 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -15.208 -12.211 -1.400 1.00 0.00 O flip ATOM 1224 ND2 ASN A 197 -15.189 -14.238 -0.478 1.00 0.00 N flip ATOM 0 H ASN A 197 -13.611 -10.460 2.908 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.940 -12.037 0.580 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.882 -13.228 1.778 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.851 -11.844 1.311 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -15.132 -14.840 0.344 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -15.290 -14.650 -1.406 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.890 -9.414 0.276 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.851 -8.211 -0.551 1.00 0.00 C ATOM 1233 C PHE A 198 -13.366 -8.468 -1.980 1.00 0.00 C ATOM 1234 O PHE A 198 -13.563 -9.613 -2.394 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.405 -7.709 -0.634 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.782 -7.192 0.646 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -11.188 -5.952 1.177 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.672 -7.853 1.200 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -10.420 -5.326 2.171 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.946 -7.260 2.244 1.00 0.00 C ATOM 1241 CZ PHE A 198 -9.297 -5.980 2.700 1.00 0.00 C ATOM 0 H PHE A 198 -11.983 -9.644 0.682 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.502 -7.470 -0.087 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.785 -8.524 -1.008 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.365 -6.912 -1.376 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -12.092 -5.482 0.819 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.377 -8.820 0.821 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.693 -4.344 2.528 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.119 -7.787 2.696 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.701 -5.497 3.460 1.00 0.00 H new ATOM 1251 N THR A 199 -13.508 -7.386 -2.745 1.00 0.00 N ATOM 1252 CA THR A 199 -14.034 -7.292 -4.099 1.00 0.00 C ATOM 1253 C THR A 199 -13.257 -6.244 -4.912 1.00 0.00 C ATOM 1254 O THR A 199 -12.375 -5.574 -4.377 1.00 0.00 O ATOM 1255 CB THR A 199 -15.548 -6.996 -4.024 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.975 -6.419 -2.805 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.281 -8.323 -4.051 1.00 0.00 C ATOM 0 H THR A 199 -13.230 -6.469 -2.396 1.00 0.00 H new ATOM 0 HA THR A 199 -13.901 -8.237 -4.625 1.00 0.00 H new ATOM 0 HB THR A 199 -15.750 -6.313 -4.849 1.00 0.00 H new ATOM 0 HG1 THR A 199 -15.722 -5.473 -2.785 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.355 -8.146 -3.999 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.044 -8.851 -4.975 1.00 0.00 H new ATOM 0 HG23 THR A 199 -15.971 -8.927 -3.198 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.574 -6.100 -6.203 1.00 0.00 N ATOM 1266 CA GLU A 200 -12.943 -5.170 -7.143 1.00 0.00 C ATOM 1267 C GLU A 200 -12.935 -3.738 -6.614 1.00 0.00 C ATOM 1268 O GLU A 200 -11.900 -3.078 -6.657 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.688 -5.224 -8.493 1.00 0.00 C ATOM 1270 CG GLU A 200 -12.835 -5.828 -9.612 1.00 0.00 C ATOM 1271 CD GLU A 200 -12.565 -7.314 -9.374 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -13.489 -8.142 -9.571 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -11.459 -7.661 -8.904 1.00 0.00 O ATOM 0 H GLU A 200 -14.311 -6.654 -6.640 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.905 -5.477 -7.272 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.599 -5.812 -8.378 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.992 -4.216 -8.777 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -13.343 -5.698 -10.568 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.888 -5.292 -9.679 1.00 0.00 H new ATOM 1280 N THR A 201 -14.075 -3.254 -6.115 1.00 0.00 N ATOM 1281 CA THR A 201 -14.176 -1.870 -5.649 1.00 0.00 C ATOM 1282 C THR A 201 -13.210 -1.654 -4.480 1.00 0.00 C ATOM 1283 O THR A 201 -12.530 -0.631 -4.405 1.00 0.00 O ATOM 1284 CB THR A 201 -15.636 -1.546 -5.284 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.460 -1.822 -6.404 1.00 0.00 O ATOM 1286 CG2 THR A 201 -15.839 -0.068 -4.911 1.00 0.00 C ATOM 0 H THR A 201 -14.935 -3.795 -6.024 1.00 0.00 H new ATOM 0 HA THR A 201 -13.887 -1.180 -6.441 1.00 0.00 H new ATOM 0 HB THR A 201 -15.895 -2.158 -4.420 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.393 -1.621 -6.181 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.886 0.104 -4.663 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.217 0.179 -4.051 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.558 0.562 -5.755 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.105 -2.651 -3.601 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.241 -2.614 -2.430 1.00 0.00 C ATOM 1296 C ASP A 202 -10.791 -2.535 -2.885 1.00 0.00 C ATOM 1297 O ASP A 202 -10.044 -1.704 -2.371 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.424 -3.855 -1.542 1.00 0.00 C ATOM 1299 CG ASP A 202 -13.869 -4.211 -1.236 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -14.660 -4.419 -2.185 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -14.241 -4.402 -0.061 1.00 0.00 O ATOM 0 H ASP A 202 -13.630 -3.521 -3.688 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.511 -1.738 -1.840 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -11.950 -4.707 -2.030 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.897 -3.693 -0.602 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.419 -3.361 -3.866 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.086 -3.425 -4.449 1.00 0.00 C ATOM 1308 C VAL A 203 -8.708 -2.081 -5.071 1.00 0.00 C ATOM 1309 O VAL A 203 -7.581 -1.627 -4.879 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.024 -4.600 -5.451 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.856 -4.521 -6.444 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -8.919 -5.919 -4.672 1.00 0.00 C ATOM 0 H VAL A 203 -11.066 -4.027 -4.289 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.344 -3.618 -3.675 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.939 -4.545 -6.041 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.886 -5.383 -7.111 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.938 -3.606 -7.030 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.913 -4.518 -5.897 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -8.875 -6.753 -5.373 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.016 -5.910 -4.061 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -9.791 -6.032 -4.028 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.618 -1.417 -5.787 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.311 -0.121 -6.387 1.00 0.00 C ATOM 1324 C LYS A 204 -8.988 0.916 -5.318 1.00 0.00 C ATOM 1325 O LYS A 204 -7.993 1.628 -5.445 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.467 0.365 -7.256 1.00 0.00 C ATOM 1327 CG LYS A 204 -10.619 -0.461 -8.537 1.00 0.00 C ATOM 1328 CD LYS A 204 -11.448 0.305 -9.571 1.00 0.00 C ATOM 1329 CE LYS A 204 -12.907 0.421 -9.116 1.00 0.00 C ATOM 1330 NZ LYS A 204 -13.708 1.345 -9.947 1.00 0.00 N ATOM 0 H LYS A 204 -10.565 -1.753 -5.963 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.432 -0.251 -7.018 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.394 0.318 -6.684 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.307 1.411 -7.518 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -9.636 -0.691 -8.948 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -11.100 -1.412 -8.309 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.027 1.300 -9.717 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -11.401 -0.206 -10.533 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -13.367 -0.567 -9.138 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -12.931 0.761 -8.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -14.683 1.378 -9.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -13.292 2.297 -9.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -13.713 1.010 -10.932 1.00 0.00 H new ATOM 1344 N MET A 205 -9.794 1.003 -4.257 1.00 0.00 N ATOM 1345 CA MET A 205 -9.466 1.904 -3.156 1.00 0.00 C ATOM 1346 C MET A 205 -8.158 1.469 -2.485 1.00 0.00 C ATOM 1347 O MET A 205 -7.393 2.311 -2.016 1.00 0.00 O ATOM 1348 CB MET A 205 -10.572 1.923 -2.101 1.00 0.00 C ATOM 1349 CG MET A 205 -11.980 2.261 -2.582 1.00 0.00 C ATOM 1350 SD MET A 205 -12.155 3.738 -3.594 1.00 0.00 S ATOM 1351 CE MET A 205 -13.918 4.026 -3.330 1.00 0.00 C ATOM 0 H MET A 205 -10.658 0.473 -4.140 1.00 0.00 H new ATOM 0 HA MET A 205 -9.359 2.904 -3.577 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.603 0.943 -1.624 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.294 2.643 -1.332 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.358 1.412 -3.151 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.621 2.370 -1.707 1.00 0.00 H new ATOM 0 HE1 MET A 205 -14.298 4.691 -4.105 1.00 0.00 H new ATOM 0 HE2 MET A 205 -14.452 3.077 -3.372 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.069 4.484 -2.353 1.00 0.00 H new ATOM 1361 N MET A 206 -7.884 0.164 -2.426 1.00 0.00 N ATOM 1362 CA MET A 206 -6.664 -0.350 -1.836 1.00 0.00 C ATOM 1363 C MET A 206 -5.439 0.057 -2.641 1.00 0.00 C ATOM 1364 O MET A 206 -4.427 0.356 -2.015 1.00 0.00 O ATOM 1365 CB MET A 206 -6.719 -1.867 -1.668 1.00 0.00 C ATOM 1366 CG MET A 206 -5.424 -2.388 -1.039 1.00 0.00 C ATOM 1367 SD MET A 206 -5.650 -3.815 0.058 1.00 0.00 S ATOM 1368 CE MET A 206 -6.473 -4.998 -1.043 1.00 0.00 C ATOM 0 H MET A 206 -8.506 -0.559 -2.788 1.00 0.00 H new ATOM 0 HA MET A 206 -6.577 0.095 -0.845 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.569 -2.138 -1.041 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.874 -2.340 -2.638 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.732 -2.662 -1.835 1.00 0.00 H new ATOM 0 HG3 MET A 206 -4.957 -1.581 -0.475 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.514 -5.112 -0.742 1.00 0.00 H new ATOM 0 HE2 MET A 206 -6.430 -4.631 -2.069 1.00 0.00 H new ATOM 0 HE3 MET A 206 -5.970 -5.963 -0.981 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.506 0.117 -3.976 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.373 0.577 -4.774 1.00 0.00 C ATOM 1380 C GLU A 207 -3.967 1.952 -4.253 1.00 0.00 C ATOM 1381 O GLU A 207 -2.800 2.197 -3.987 1.00 0.00 O ATOM 1382 CB GLU A 207 -4.700 0.690 -6.275 1.00 0.00 C ATOM 1383 CG GLU A 207 -4.938 -0.649 -6.983 1.00 0.00 C ATOM 1384 CD GLU A 207 -4.231 -0.734 -8.332 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -4.605 0.028 -9.256 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -3.297 -1.557 -8.492 1.00 0.00 O ATOM 0 H GLU A 207 -6.328 -0.146 -4.520 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.571 -0.155 -4.678 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.588 1.311 -6.393 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -3.880 1.208 -6.773 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.591 -1.461 -6.343 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.009 -0.793 -7.128 1.00 0.00 H new ATOM 1393 N ARG A 208 -4.955 2.819 -4.029 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.793 4.223 -3.663 1.00 0.00 C ATOM 1395 C ARG A 208 -4.226 4.337 -2.254 1.00 0.00 C ATOM 1396 O ARG A 208 -3.278 5.091 -2.018 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.156 4.904 -3.762 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.697 4.920 -5.203 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.687 6.343 -5.740 1.00 0.00 C ATOM 1400 NE ARG A 208 -5.343 6.839 -6.076 1.00 0.00 N ATOM 1401 CZ ARG A 208 -4.838 6.995 -7.305 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -5.391 6.431 -8.369 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -3.775 7.763 -7.475 1.00 0.00 N ATOM 0 H ARG A 208 -5.935 2.547 -4.102 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.092 4.712 -4.340 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.866 4.388 -3.115 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.076 5.927 -3.395 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.087 4.278 -5.838 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -7.711 4.520 -5.225 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -7.315 6.391 -6.630 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -7.134 7.005 -4.998 1.00 0.00 H new ATOM 0 HE ARG A 208 -4.737 7.089 -5.295 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -6.228 5.857 -8.265 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -4.980 6.571 -9.292 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -3.349 8.229 -6.674 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -3.381 7.889 -8.407 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.813 3.585 -1.322 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.360 3.509 0.066 1.00 0.00 C ATOM 1419 C VAL A 209 -2.898 3.051 0.132 1.00 0.00 C ATOM 1420 O VAL A 209 -2.068 3.703 0.767 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.366 2.681 0.915 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -4.960 1.253 1.299 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.676 3.395 2.227 1.00 0.00 C ATOM 0 H VAL A 209 -5.629 3.003 -1.514 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.356 4.498 0.524 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.216 2.598 0.238 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.754 0.795 1.889 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.794 0.666 0.395 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.042 1.281 1.886 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.382 2.800 2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.756 3.525 2.797 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.112 4.371 2.016 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.564 1.954 -0.545 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.230 1.381 -0.534 1.00 0.00 C ATOM 1435 C VAL A 210 -0.264 2.276 -1.326 1.00 0.00 C ATOM 1436 O VAL A 210 0.934 2.253 -1.045 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.336 -0.080 -1.030 1.00 0.00 C ATOM 1438 CG1 VAL A 210 0.001 -0.721 -1.398 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -1.974 -0.978 0.041 1.00 0.00 C ATOM 0 H VAL A 210 -3.225 1.435 -1.123 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.804 1.343 0.468 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.948 -0.011 -1.929 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.166 -1.744 -1.735 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.472 -0.148 -2.197 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.653 -0.729 -0.525 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.037 -2.000 -0.332 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.363 -0.958 0.943 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -2.975 -0.613 0.272 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.760 3.105 -2.250 1.00 0.00 N ATOM 1450 CA GLU A 211 0.029 4.036 -3.033 1.00 0.00 C ATOM 1451 C GLU A 211 0.554 5.072 -2.057 1.00 0.00 C ATOM 1452 O GLU A 211 1.749 5.119 -1.821 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.797 4.665 -4.170 1.00 0.00 C ATOM 1454 CG GLU A 211 0.120 5.300 -5.203 1.00 0.00 C ATOM 1455 CD GLU A 211 -0.656 5.917 -6.360 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.017 5.191 -7.314 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -0.834 7.156 -6.379 1.00 0.00 O ATOM 0 H GLU A 211 -1.755 3.141 -2.474 1.00 0.00 H new ATOM 0 HA GLU A 211 0.855 3.531 -3.533 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.416 3.903 -4.643 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.473 5.417 -3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.727 6.068 -4.724 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.806 4.546 -5.589 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.330 5.831 -1.407 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.013 6.799 -0.360 1.00 0.00 C ATOM 1466 C GLN A 212 0.989 6.276 0.667 1.00 0.00 C ATOM 1467 O GLN A 212 1.891 7.005 1.084 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.320 7.131 0.352 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.213 7.996 -0.530 1.00 0.00 C ATOM 1470 CD GLN A 212 -1.850 9.468 -0.371 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -1.805 10.012 0.735 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.540 10.125 -1.468 1.00 0.00 N ATOM 0 H GLN A 212 -1.329 5.784 -1.606 1.00 0.00 H new ATOM 0 HA GLN A 212 0.449 7.669 -0.827 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.841 6.210 0.613 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.108 7.653 1.285 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.103 7.698 -1.573 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.258 7.842 -0.263 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.584 9.656 -2.373 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.256 11.103 -1.414 1.00 0.00 H new ATOM 1481 N MET A 213 0.822 5.026 1.088 1.00 0.00 N ATOM 1482 CA MET A 213 1.727 4.410 2.043 1.00 0.00 C ATOM 1483 C MET A 213 3.115 4.240 1.424 1.00 0.00 C ATOM 1484 O MET A 213 4.091 4.751 1.976 1.00 0.00 O ATOM 1485 CB MET A 213 1.112 3.102 2.545 1.00 0.00 C ATOM 1486 CG MET A 213 0.097 3.393 3.656 1.00 0.00 C ATOM 1487 SD MET A 213 -1.384 2.342 3.770 1.00 0.00 S ATOM 1488 CE MET A 213 -0.686 0.706 3.477 1.00 0.00 C ATOM 0 H MET A 213 0.062 4.420 0.779 1.00 0.00 H new ATOM 0 HA MET A 213 1.866 5.052 2.913 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.623 2.581 1.722 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.895 2.443 2.920 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.622 3.332 4.610 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.236 4.425 3.540 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.466 -0.047 3.588 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.278 0.660 2.467 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.108 0.515 4.199 1.00 0.00 H new ATOM 1498 N CYS A 214 3.233 3.560 0.281 1.00 0.00 N ATOM 1499 CA CYS A 214 4.538 3.344 -0.336 1.00 0.00 C ATOM 1500 C CYS A 214 5.109 4.607 -0.997 1.00 0.00 C ATOM 1501 O CYS A 214 6.309 4.662 -1.242 1.00 0.00 O ATOM 1502 CB CYS A 214 4.506 2.149 -1.285 1.00 0.00 C ATOM 1503 SG CYS A 214 5.768 0.902 -0.926 1.00 0.00 S ATOM 0 H CYS A 214 2.448 3.155 -0.229 1.00 0.00 H new ATOM 0 HA CYS A 214 5.233 3.104 0.469 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.522 1.683 -1.235 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.639 2.504 -2.307 1.00 0.00 H new ATOM 1508 N VAL A 215 4.309 5.646 -1.231 1.00 0.00 N ATOM 1509 CA VAL A 215 4.747 6.979 -1.615 1.00 0.00 C ATOM 1510 C VAL A 215 5.589 7.546 -0.477 1.00 0.00 C ATOM 1511 O VAL A 215 6.727 7.953 -0.706 1.00 0.00 O ATOM 1512 CB VAL A 215 3.536 7.865 -1.992 1.00 0.00 C ATOM 1513 CG1 VAL A 215 3.886 9.360 -2.013 1.00 0.00 C ATOM 1514 CG2 VAL A 215 2.943 7.509 -3.367 1.00 0.00 C ATOM 0 H VAL A 215 3.294 5.574 -1.154 1.00 0.00 H new ATOM 0 HA VAL A 215 5.368 6.946 -2.510 1.00 0.00 H new ATOM 0 HB VAL A 215 2.801 7.666 -1.212 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.002 9.937 -2.283 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.232 9.667 -1.026 1.00 0.00 H new ATOM 0 HG13 VAL A 215 4.674 9.539 -2.745 1.00 0.00 H new ATOM 0 HG21 VAL A 215 2.097 8.163 -3.579 1.00 0.00 H new ATOM 0 HG22 VAL A 215 3.704 7.640 -4.136 1.00 0.00 H new ATOM 0 HG23 VAL A 215 2.608 6.472 -3.361 1.00 0.00 H new ATOM 1524 N THR A 216 5.062 7.582 0.747 1.00 0.00 N ATOM 1525 CA THR A 216 5.831 8.016 1.902 1.00 0.00 C ATOM 1526 C THR A 216 7.027 7.089 2.111 1.00 0.00 C ATOM 1527 O THR A 216 8.131 7.584 2.303 1.00 0.00 O ATOM 1528 CB THR A 216 4.900 8.027 3.126 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.920 9.031 2.950 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.637 8.222 4.456 1.00 0.00 C ATOM 0 H THR A 216 4.101 7.314 0.959 1.00 0.00 H new ATOM 0 HA THR A 216 6.224 9.021 1.747 1.00 0.00 H new ATOM 0 HB THR A 216 4.434 7.043 3.189 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.321 9.043 3.726 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.917 8.219 5.275 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.352 7.411 4.598 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.167 9.174 4.442 1.00 0.00 H new ATOM 1538 N GLN A 217 6.843 5.767 2.079 1.00 0.00 N ATOM 1539 CA GLN A 217 7.948 4.845 2.313 1.00 0.00 C ATOM 1540 C GLN A 217 9.056 5.049 1.270 1.00 0.00 C ATOM 1541 O GLN A 217 10.212 5.113 1.660 1.00 0.00 O ATOM 1542 CB GLN A 217 7.421 3.402 2.402 1.00 0.00 C ATOM 1543 CG GLN A 217 7.566 2.824 3.821 1.00 0.00 C ATOM 1544 CD GLN A 217 8.967 2.320 4.137 1.00 0.00 C ATOM 1545 OE1 GLN A 217 9.690 1.878 3.261 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.362 2.315 5.397 1.00 0.00 N ATOM 0 H GLN A 217 5.946 5.318 1.895 1.00 0.00 H new ATOM 0 HA GLN A 217 8.414 5.057 3.275 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.372 3.380 2.107 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.964 2.773 1.697 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.294 3.591 4.546 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.858 2.004 3.944 1.00 0.00 H new ATOM 0 HE21 GLN A 217 8.751 2.687 6.124 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.278 1.939 5.643 1.00 0.00 H new ATOM 1555 N TYR A 218 8.744 5.266 -0.011 1.00 0.00 N ATOM 1556 CA TYR A 218 9.738 5.618 -1.023 1.00 0.00 C ATOM 1557 C TYR A 218 10.456 6.910 -0.646 1.00 0.00 C ATOM 1558 O TYR A 218 11.682 6.949 -0.661 1.00 0.00 O ATOM 1559 CB TYR A 218 9.070 5.798 -2.386 1.00 0.00 C ATOM 1560 CG TYR A 218 10.018 6.157 -3.517 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.020 5.251 -3.914 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.898 7.394 -4.180 1.00 0.00 C ATOM 1563 CE1 TYR A 218 11.889 5.573 -4.974 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.731 7.691 -5.270 1.00 0.00 C ATOM 1565 CZ TYR A 218 11.743 6.797 -5.664 1.00 0.00 C ATOM 1566 OH TYR A 218 12.561 7.124 -6.700 1.00 0.00 O ATOM 0 H TYR A 218 7.793 5.202 -0.374 1.00 0.00 H new ATOM 0 HA TYR A 218 10.463 4.806 -1.077 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.551 4.875 -2.645 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.313 6.578 -2.304 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.122 4.305 -3.403 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.164 8.114 -3.849 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.669 4.883 -5.260 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.594 8.615 -5.812 1.00 0.00 H new ATOM 0 HH TYR A 218 12.309 8.003 -7.051 1.00 0.00 H new ATOM 1576 N GLN A 219 9.709 7.964 -0.302 1.00 0.00 N ATOM 1577 CA GLN A 219 10.279 9.243 0.106 1.00 0.00 C ATOM 1578 C GLN A 219 11.257 9.050 1.264 1.00 0.00 C ATOM 1579 O GLN A 219 12.368 9.577 1.222 1.00 0.00 O ATOM 1580 CB GLN A 219 9.165 10.234 0.470 1.00 0.00 C ATOM 1581 CG GLN A 219 8.437 10.753 -0.770 1.00 0.00 C ATOM 1582 CD GLN A 219 7.331 11.734 -0.412 1.00 0.00 C ATOM 1583 OE1 GLN A 219 6.091 11.303 -0.538 1.00 0.00 O flip ATOM 1584 NE2 GLN A 219 7.578 12.887 -0.059 1.00 0.00 N flip ATOM 0 H GLN A 219 8.689 7.950 -0.300 1.00 0.00 H new ATOM 0 HA GLN A 219 10.837 9.662 -0.732 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.450 9.749 1.134 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.591 11.074 1.019 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.152 11.239 -1.433 1.00 0.00 H new ATOM 0 HG3 GLN A 219 8.013 9.913 -1.320 1.00 0.00 H new ATOM 0 HE21 GLN A 219 8.546 13.197 0.031 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.815 13.533 0.143 1.00 0.00 H new ATOM 1593 N LYS A 220 10.867 8.287 2.283 1.00 0.00 N ATOM 1594 CA LYS A 220 11.683 7.956 3.434 1.00 0.00 C ATOM 1595 C LYS A 220 12.905 7.144 3.040 1.00 0.00 C ATOM 1596 O LYS A 220 13.987 7.488 3.505 1.00 0.00 O ATOM 1597 CB LYS A 220 10.871 7.170 4.458 1.00 0.00 C ATOM 1598 CG LYS A 220 9.785 8.003 5.151 1.00 0.00 C ATOM 1599 CD LYS A 220 8.843 7.120 5.978 1.00 0.00 C ATOM 1600 CE LYS A 220 9.314 6.767 7.392 1.00 0.00 C ATOM 1601 NZ LYS A 220 10.595 6.033 7.490 1.00 0.00 N ATOM 0 H LYS A 220 9.937 7.870 2.325 1.00 0.00 H new ATOM 0 HA LYS A 220 12.016 8.897 3.872 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.404 6.319 3.963 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.546 6.768 5.213 1.00 0.00 H new ATOM 0 HG2 LYS A 220 10.252 8.745 5.798 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.211 8.549 4.403 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.880 7.624 6.054 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.675 6.192 5.431 1.00 0.00 H new ATOM 0 HE2 LYS A 220 9.404 7.691 7.964 1.00 0.00 H new ATOM 0 HE3 LYS A 220 8.539 6.169 7.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 10.668 5.586 8.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 10.633 5.301 6.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 11.386 6.696 7.360 1.00 0.00 H new ATOM 1615 N GLU A 221 12.746 6.074 2.269 1.00 0.00 N ATOM 1616 CA GLU A 221 13.820 5.166 1.894 1.00 0.00 C ATOM 1617 C GLU A 221 14.846 5.900 1.048 1.00 0.00 C ATOM 1618 O GLU A 221 16.025 5.886 1.378 1.00 0.00 O ATOM 1619 CB GLU A 221 13.270 3.952 1.129 1.00 0.00 C ATOM 1620 CG GLU A 221 12.591 2.932 2.048 1.00 0.00 C ATOM 1621 CD GLU A 221 13.552 2.350 3.080 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.559 1.714 2.685 1.00 0.00 O ATOM 1623 OE2 GLU A 221 13.281 2.509 4.295 1.00 0.00 O ATOM 0 H GLU A 221 11.842 5.809 1.878 1.00 0.00 H new ATOM 0 HA GLU A 221 14.300 4.804 2.804 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.555 4.293 0.380 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.085 3.466 0.593 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.756 3.409 2.561 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.176 2.124 1.446 1.00 0.00 H new ATOM 1630 N SER A 222 14.410 6.575 -0.013 1.00 0.00 N ATOM 1631 CA SER A 222 15.288 7.356 -0.859 1.00 0.00 C ATOM 1632 C SER A 222 16.014 8.432 -0.084 1.00 0.00 C ATOM 1633 O SER A 222 17.224 8.571 -0.260 1.00 0.00 O ATOM 1634 CB SER A 222 14.486 8.045 -1.941 1.00 0.00 C ATOM 1635 OG SER A 222 14.071 7.116 -2.921 1.00 0.00 O ATOM 0 H SER A 222 13.433 6.591 -0.305 1.00 0.00 H new ATOM 0 HA SER A 222 16.014 6.661 -1.281 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.615 8.531 -1.502 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.088 8.827 -2.405 1.00 0.00 H new ATOM 0 HG SER A 222 13.552 7.579 -3.612 1.00 0.00 H new ATOM 1641 N GLN A 223 15.317 9.193 0.768 1.00 0.00 N ATOM 1642 CA GLN A 223 15.986 10.162 1.584 1.00 0.00 C ATOM 1643 C GLN A 223 16.999 9.440 2.451 1.00 0.00 C ATOM 1644 O GLN A 223 18.147 9.835 2.527 1.00 0.00 O ATOM 1645 CB GLN A 223 14.888 10.806 2.402 1.00 0.00 C ATOM 1646 CG GLN A 223 15.282 11.591 3.649 1.00 0.00 C ATOM 1647 CD GLN A 223 13.986 12.047 4.311 1.00 0.00 C ATOM 1648 OE1 GLN A 223 13.091 11.097 4.558 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 13.791 13.225 4.599 1.00 0.00 N flip ATOM 0 H GLN A 223 14.306 9.144 0.896 1.00 0.00 H new ATOM 0 HA GLN A 223 16.532 10.918 1.019 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.336 11.479 1.746 1.00 0.00 H new ATOM 0 HB3 GLN A 223 14.197 10.021 2.708 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.865 10.970 4.329 1.00 0.00 H new ATOM 0 HG3 GLN A 223 15.904 12.447 3.386 1.00 0.00 H new ATOM 0 HE21 GLN A 223 14.504 13.925 4.393 1.00 0.00 H new ATOM 0 HE22 GLN A 223 12.917 13.503 5.044 1.00 0.00 H new ATOM 1658 N ALA A 224 16.622 8.350 3.101 1.00 0.00 N ATOM 1659 CA ALA A 224 17.554 7.670 3.968 1.00 0.00 C ATOM 1660 C ALA A 224 18.760 7.100 3.197 1.00 0.00 C ATOM 1661 O ALA A 224 19.842 7.002 3.773 1.00 0.00 O ATOM 1662 CB ALA A 224 16.792 6.590 4.751 1.00 0.00 C ATOM 0 H ALA A 224 15.695 7.929 3.043 1.00 0.00 H new ATOM 0 HA ALA A 224 17.981 8.385 4.671 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.482 6.065 5.412 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.006 7.057 5.344 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.347 5.880 4.053 1.00 0.00 H new ATOM 1668 N ALA A 225 18.603 6.789 1.907 1.00 0.00 N ATOM 1669 CA ALA A 225 19.628 6.238 1.033 1.00 0.00 C ATOM 1670 C ALA A 225 20.546 7.303 0.418 1.00 0.00 C ATOM 1671 O ALA A 225 21.695 6.985 0.102 1.00 0.00 O ATOM 1672 CB ALA A 225 18.960 5.420 -0.079 1.00 0.00 C ATOM 0 H ALA A 225 17.713 6.923 1.427 1.00 0.00 H new ATOM 0 HA ALA A 225 20.265 5.604 1.650 1.00 0.00 H new ATOM 0 HB1 ALA A 225 19.725 5.006 -0.736 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.383 4.608 0.363 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.297 6.064 -0.656 1.00 0.00 H new ATOM 1678 N ALA A 226 20.079 8.540 0.213 1.00 0.00 N ATOM 1679 CA ALA A 226 20.819 9.595 -0.484 1.00 0.00 C ATOM 1680 C ALA A 226 21.072 10.829 0.391 1.00 0.00 C ATOM 1681 O ALA A 226 22.050 11.548 0.166 1.00 0.00 O ATOM 1682 CB ALA A 226 20.089 9.953 -1.783 1.00 0.00 C ATOM 0 H ALA A 226 19.158 8.840 0.534 1.00 0.00 H new ATOM 0 HA ALA A 226 21.810 9.209 -0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 226 20.637 10.738 -2.304 1.00 0.00 H new ATOM 0 HB2 ALA A 226 20.026 9.071 -2.420 1.00 0.00 H new ATOM 0 HB3 ALA A 226 19.084 10.305 -1.550 1.00 0.00 H new ATOM 1688 N ASP A 227 20.269 11.019 1.435 1.00 0.00 N ATOM 1689 CA ASP A 227 20.489 11.934 2.554 1.00 0.00 C ATOM 1690 C ASP A 227 21.200 11.247 3.718 1.00 0.00 C ATOM 1691 O ASP A 227 21.730 11.929 4.589 1.00 0.00 O ATOM 1692 CB ASP A 227 19.164 12.528 3.076 1.00 0.00 C ATOM 1693 CG ASP A 227 19.340 13.904 3.754 1.00 0.00 C ATOM 1694 OD1 ASP A 227 20.375 14.589 3.545 1.00 0.00 O ATOM 1695 OD2 ASP A 227 18.404 14.328 4.474 1.00 0.00 O ATOM 0 H ASP A 227 19.392 10.506 1.529 1.00 0.00 H new ATOM 0 HA ASP A 227 21.119 12.734 2.166 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.465 12.626 2.245 1.00 0.00 H new ATOM 0 HB3 ASP A 227 18.718 11.834 3.788 1.00 0.00 H new ATOM 1700 N GLY A 228 21.208 9.909 3.767 1.00 0.00 N ATOM 1701 CA GLY A 228 21.846 9.148 4.841 1.00 0.00 C ATOM 1702 C GLY A 228 20.980 9.010 6.094 1.00 0.00 C ATOM 1703 O GLY A 228 21.433 8.467 7.098 1.00 0.00 O ATOM 0 H GLY A 228 20.769 9.323 3.057 1.00 0.00 H new ATOM 0 HA2 GLY A 228 22.096 8.154 4.471 1.00 0.00 H new ATOM 0 HA3 GLY A 228 22.784 9.633 5.110 1.00 0.00 H new ATOM 1707 N ARG A 229 19.722 9.459 6.055 1.00 0.00 N ATOM 1708 CA ARG A 229 18.757 9.487 7.165 1.00 0.00 C ATOM 1709 C ARG A 229 18.190 8.102 7.503 1.00 0.00 C ATOM 1710 O ARG A 229 16.986 7.965 7.735 1.00 0.00 O ATOM 1711 CB ARG A 229 17.642 10.486 6.806 1.00 0.00 C ATOM 1712 CG ARG A 229 18.115 11.938 6.655 1.00 0.00 C ATOM 1713 CD ARG A 229 18.331 12.628 8.008 1.00 0.00 C ATOM 1714 NE ARG A 229 17.509 13.840 8.147 1.00 0.00 N ATOM 1715 CZ ARG A 229 17.201 14.440 9.301 1.00 0.00 C ATOM 1716 NH1 ARG A 229 17.567 13.905 10.464 1.00 0.00 N ATOM 1717 NH2 ARG A 229 16.514 15.574 9.297 1.00 0.00 N ATOM 0 H ARG A 229 19.323 9.837 5.196 1.00 0.00 H new ATOM 0 HA ARG A 229 19.273 9.809 8.070 1.00 0.00 H new ATOM 0 HB2 ARG A 229 17.175 10.170 5.873 1.00 0.00 H new ATOM 0 HB3 ARG A 229 16.873 10.446 7.577 1.00 0.00 H new ATOM 0 HG2 ARG A 229 19.046 11.957 6.088 1.00 0.00 H new ATOM 0 HG3 ARG A 229 17.379 12.498 6.078 1.00 0.00 H new ATOM 0 HD2 ARG A 229 18.090 11.933 8.812 1.00 0.00 H new ATOM 0 HD3 ARG A 229 19.383 12.889 8.118 1.00 0.00 H new ATOM 0 HE ARG A 229 17.143 14.257 7.291 1.00 0.00 H new ATOM 0 HH11 ARG A 229 18.088 13.028 10.481 1.00 0.00 H new ATOM 0 HH12 ARG A 229 17.326 14.372 11.338 1.00 0.00 H new ATOM 0 HH21 ARG A 229 16.220 15.989 8.413 1.00 0.00 H new ATOM 0 HH22 ARG A 229 16.279 16.031 10.178 1.00 0.00 H new